SCHEMBL354093

SCHEMBL354093

CNC(=O)c1nonc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.47
ALDH1A1 P00352 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
GAA P10253 4/20 0.43
ALPL P05186 1/20 0.43
ALPI P09923 1/20 0.43
ALPG P10696 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NOD2 Q9HC29 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
NOD1 Q9Y239 1/20 0.40
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 3/20 0.38
CYP2C9 P11712 2/20 0.36

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
SCHEMBL29184492 0.84 PKM (0.49) PKMALDH1A1RXFP1GAAALPL
SCHEMBL25874132 0.81 PKM (0.46) PKMALDH1A1RXFP1GAAALPL
SCHEMBL23135525 0.78 PKM (0.44) PKMALDH1A1RXFP1GAAALPL
SCHEMBL25481082 0.78 PKM (0.44) PKMALDH1A1RXFP1GAAALPL
SCHEMBL24130245 0.78 PKM (0.47) PKMALDH1A1RXFP1GAAALPL
SCHEMBL22207679 0.77 KMT2A (0.50) ALDH1A1GAAHPGDSMN1; SMN2KMT2A
SCHEMBL22207701 0.77 KMT2A (0.33) PKMALDH1A1GAARAB9ASMN1; SMN2
SCHEMBL25447714 0.76 PKM (0.43) PKMALDH1A1RXFP1GAAALPL
SCHEMBL10242678 0.75
SCHEMBL261709 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159465-A1 IMMUNOMODULATOR HITGEN INC. (CN) 2023-05-25 US disclosed
US-20230141212-A1 SUBSTITUTED BENZENECARBOXAMIDES AS IL-17A MODULATORS DICE ALPHA, INC. 2023-05-11 US disclosed
WO-2022128584-A1 IMIDAZOPYRIDAZINE DERIVATIVES AS IL-17 MODULATORS UCB Biopharma SRL (BE) 2022-06-23 WO disclosed
US-20210101886-A1 IL-17A MODULATORS AND USES THEREOF DICE ALPHA, INC. 2021-04-08 US disclosed
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US disclosed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 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 (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-20230159465-A1 IMMUNOMODULATOR IL2, IL17A, IL2RA PKM 4644/4885ALDH1A1 302/4885RXFP1 2458/4885
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA PKM 3200/4885ALDH1A1 2806/4885RXFP1 4234/4885
US-20230141212-A1 SUBSTITUTED BENZENECARBOXAMIDES AS IL-17A MODULATORS IL17A, IL2, IL23R PKM 4419/4885ALDH1A1 372/4885RXFP1 4045/4885
US-20210101886-A1 IL-17A MODULATORS AND USES THEREOF IL17A, IL2, IL36G PKM 3836/4885ALDH1A1 1072/4885RXFP1 2871/4885

“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.