SCHEMBL4397150

SCHEMBL4397150

O=C(O)c1cccc(N2CCCS2(=O)=O)c1

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.91
TP53 P04637 8/20 0.62
ALDH1A1 P00352 3/20 0.58
HPGD P15428 2/20 0.58
KDM4E B2RXH2 2/20 0.58
MEN1 O00255 2/20 0.58
GAA P10253 2/20 0.58
KMT2A Q03164 2/20 0.58
HSD17B10 Q99714 2/20 0.58
MAPT P10636 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
KMO O15229 1/20 0.50
USP2 O75604 1/20 0.46
MYC P01106 1/20 0.46
HSPA1A P0DMV8 1/20 0.46

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
SCHEMBL14584575 0.87 POLB (0.70) POLBTP53ALDH1A1HPGDKDM4E
SCHEMBL4831916 0.85 POLB (0.68) POLBTP53ALDH1A1HPGDKDM4E
SCHEMBL6828696 0.84 TP53 (0.67) POLBTP53ALDH1A1HPGDGAA
SCHEMBL4833669 0.81 TP53 (0.64) POLBTP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL1937229 0.81 POLB (0.61) POLBTP53ALDH1A1HPGDKDM4E
SCHEMBL4401152 0.80 POLB (0.61) POLBTP53MAPTSMN1; SMN2CTSD
SCHEMBL5900600 0.79 POLB (0.59) POLBTP53MAPTSMN1; SMN2
SCHEMBL14584576 0.78 POLB (0.58) POLBTP53ALDH1A1HPGDGAA
SCHEMBL1787817 0.76 POLB (0.56) POLBTP53MAPTSMN1; SMN2
SCHEMBL12547064 0.76 POLB (0.56) POLBTP53MAPTSMN1; SMN2

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
WO-2020011731-A1 SPIROCYCLIC INDANE ANALOGUES AS IL-17 MODULATORS UCB Biopharma SRL (BE) 2020-01-16 WO disclosed
EP-1959951-B1 HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS HOFFMANN LA ROCHE (CH) 2009-12-23 EP disclosed
US-7442704-B2 Amide derivatives ASTRAZENECA AB (SE) 2008-10-28 US disclosed
US-7332483-B2 3-(5-benzamido-2-chlorophenyl)-7-methoxy-3,4-dihydroquinazolin-4-one;cytokines (tumor necrosis factor and interleukins) inhibitor; antiinflammatory agent, rheumatoid arthritis, osteoarthritis, psoriasis, chronic obstructive pulmonary disease ASTRAZENECA AB (SE) 2008-02-19 US disclosed
US-20060281734-A1 Amide derivatives BROWN DEARG S 2006-12-14 US disclosed
US-7008945-B1 Amide derivatives ASTRAZENECA AB (SE) 2006-03-07 US disclosed
US-20050245551-A1 Amide derivatives ASTRAZENECA AB 2005-11-03 US disclosed
WO-2005030709-A1 NOVEL SULFONE AMIDE DERIVATIVES CAPABLE OF INHIBITING BACE LG LIFE SCIENCES LTD. (KR) 2005-04-07 WO disclosed
WO-2004111022-A1 3-(1,1-DIOXOTETRAHYDRO-1,2-THIAZIN-2-YL) or 3-(1,1-DOXO-ISOTHIAZOLIDIN-2YL) SUBSTITUTED BENZAMIDE COMPOUNDS AS ASP2 INHIBITORS GLAXO GROUP LIMITED (GB) 2004-12-23 WO disclosed
EP-1163237-A1 AMIDE DERIVATIVES AstraZeneca AB (SE) 2001-12-19 EP disclosed
WO-2000055153-A1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2000-09-21 WO 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 (4 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 POLB 3767/4885TP53 2999/4885ALDH1A1 195/4885
US-20050245551-A1 Amide derivatives IL6, IL6ST, IL1B POLB 3576/4885TP53 2400/4885ALDH1A1 269/4885
US-20060281734-A1 Amide derivatives IL6, IL6ST, IL1B POLB 3576/4885TP53 2400/4885ALDH1A1 269/4885
US-11458124-B2 Spirocyclic indane analogues as IL-17 modulators IL17A, IL18, IL23R POLB 3767/4885TP53 2999/4885ALDH1A1 195/4885

“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.