SCHEMBL35452

SCHEMBL35452

CS(=O)(=O)Cc1cccc(C(=O)O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.58
MRGPRX4 Q96LA9 5/20 0.49
TP53 P04637 2/20 0.49
PKM P14618 2/20 0.49
NFKB1 P19838 2/20 0.49
NFKB2 Q00653 2/20 0.49
RELA Q04206 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
RAB9A P51151 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
HIF1A Q16665 1/20 0.47
ANPEP P15144 1/20 0.47
ENPEP Q07075 1/20 0.47
AKR1C3 P42330 1/20 0.47
MEP1B Q16820 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31401245 1.00 FOLH1 (0.58) FOLH1MRGPRX4TP53PKMNFKB1
SCHEMBL11816773 0.86 ALDH1A1 (0.51) MRGPRX4SMN1; SMN2
SCHEMBL6011976 0.84 FOLH1 (0.56) FOLH1MRGPRX4TP53PKMNFKB1
SCHEMBL29108709 0.84 FOLH1 (0.59) FOLH1CA1CA2CA9CYP2D6
SCHEMBL7393646 0.82 FOLH1 (0.58) FOLH1MRGPRX4TP53NFKB1NFKB2
SCHEMBL22623401 0.82 FOLH1 (0.58) FOLH1MRGPRX4CA1CA2CA9
SCHEMBL31720548 0.82 FOLH1 (0.58) FOLH1CA1CA2CA9CYP2D6
SCHEMBL35360 0.81 LOXL2 (0.64) FOLH1MRGPRX4SMN1; SMN2CA1CA2
SCHEMBL5304881 0.81 FOLH1 (0.53) FOLH1MRGPRX4TP53PKMNFKB1
SCHEMBL27993553 0.80 LOXL2 (0.46) MRGPRX4CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2024-04-11 US disclosed
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2023-08-24 US disclosed
US-11458124-B2 Spirocyclic indane analogues as IL-17 modulators UCBBiopharma Srl (BE) 2022-10-04 US disclosed
US-20210228547-A1 Spirocyclic Indane Analogues as IL-17 Modulators UCB BIOPHARMA SRL (SOCIETE A RESPONSABILITE LIMITEE) (BE) 2021-07-29 US disclosed
EP-3820567-A1 SPIROCYCLIC INDANE ANALOGUES AS IL-17 MODULATORS UCB Biopharma SRL (BE) 2021-05-19 EP disclosed
US-20210070707-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2021-03-11 US disclosed
CN-112334192-A Spirocyclic indane analogs as IL-17 modulators UCB生物制药有限责任公司 2021-02-05 CN disclosed
US-20200190030-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2020-06-18 US disclosed
WO-2020011731-A1 SPIROCYCLIC INDANE ANALOGUES AS IL-17 MODULATORS UCB Biopharma SRL (BE) 2020-01-16 WO disclosed
US-20180258043-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2018-09-13 US disclosed
EP-1322611-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2003-07-02 EP disclosed
US-20030119810-A1 Pharmaceutical compositions containing 3-aminoazetidine derivatives, novel derivatives and their preparation AVENTIS PHARMA S.A. (FR) 2003-06-26 US disclosed
US-6566356-B2 3-amido or 3-sulfonylamino azetidine compounds and their preparation; high affinity for cannabinoid receptor CB1 type, useful in treating central nervous system, immune, gastrointestinal or cardiovascular disorders, drug abuse AVENTIS PHARMA S.A. (FR) 2003-05-20 US disclosed
US-20030055033-A1 Azetidine derivatives, their preparation and pharmaceutical compositions containing them ACHARD DANIEL (FR) 2003-03-20 US disclosed
US-6518264-B2 For treatment/prevention of psychoses, other brain disorders, and cardiovascular disorders AVENTIS PHARMA S.A. (FR) 2003-02-11 US disclosed
US-6479479-B2 1-DIARYLMETHYL-4-ALKYL OR ALKYLSULFONYLALKYL-AZETIDINES; CANNABINOID RECEPTOR ANTAGONISTS; NERVOUS SYSTEM DISORDERS (CNS); CARDIOVASCULAR AND GLANDULAR DISORDERS; DRUG ABUSE; PSYCHOLOGICAL DISORDERS; AVENTIS PHARMA S.A. (FR) 2002-11-12 US disclosed
US-20020035102-A1 Azetidine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2002-03-21 US disclosed
WO-2002020484-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2002-03-14 WO disclosed
US-20020019383-A1 Pharmaceutical compositions containing 3-aminoazetidine derivatives, novel derivatives and their preparation AVENTIS PHARMA S.A. (FR) 2002-02-14 US disclosed
US-20010027193-A1 Azetidine derivatives, their preparation and pharmaceutical compositions containing them AVENTIS PHARMA S.A. (FR) 2001-10-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210228547-A1 Spirocyclic Indane Analogues as IL-17 Modulators IL17A, IL18, IL23R FOLH1 3604/4885MRGPRX4 2400/4885TP53 2999/4885
US-20200190030-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO FOLH1 2409/4885MRGPRX4 401/4885TP53 758/4885
US-20010027193-A1 Azetidine derivatives, their preparation and pharmaceutical compositions containing them ALK, CYP2C9, CBR1 FOLH1 4467/4885MRGPRX4 974/4885TP53 3337/4885
US-20020019383-A1 Pharmaceutical compositions containing 3-aminoazetidine derivatives, novel derivatives and their preparation HRH2, ALK, HRH1 FOLH1 4209/4885MRGPRX4 746/4885TP53 4746/4885
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO FOLH1 2409/4885MRGPRX4 401/4885TP53 758/4885
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING SHH, GLI1, SMO FOLH1 2528/4885MRGPRX4 437/4885TP53 775/4885
US-20030055033-A1 Azetidine derivatives, their preparation and pharmaceutical compositions containing them ALK, CYP2C9, CBR1 FOLH1 4467/4885MRGPRX4 974/4885TP53 3337/4885
US-20030119810-A1 Pharmaceutical compositions containing 3-aminoazetidine derivatives, novel derivatives and their preparation ALK, HRH2, HRH1 FOLH1 4388/4885MRGPRX4 829/4885TP53 4832/4885
US-11458124-B2 Spirocyclic indane analogues as IL-17 modulators IL17A, IL18, IL23R FOLH1 3604/4885MRGPRX4 2400/4885TP53 2999/4885
US-20210070707-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO FOLH1 2409/4885MRGPRX4 401/4885TP53 758/4885
US-20180258043-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO FOLH1 2409/4885MRGPRX4 401/4885TP53 758/4885
US-20020035102-A1 Azetidine derivatives, their preparation and medicaments containing them CYP11B2, AZI2, CYP2C19 FOLH1 4446/4885MRGPRX4 1071/4885TP53 2422/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.