SCHEMBL22029397

SCHEMBL22029397

Cc1cccc(C)c1NC(=O)c1cn(C)nc1C(F)F

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
ALDH1A1 P00352 1/20 0.44
ATM Q13315 1/20 0.42
TSHR P16473 1/20 0.42
NAMPT P43490 1/20 0.41
NPC1 O15118 1/20 0.41
KDM4E B2RXH2 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
DHODH Q02127 4/20 0.40
MAPT P10636 1/20 0.40
PTGER4 P35408 1/20 0.40

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
SCHEMBL23367851 0.86 NPC1 (0.50) POLBALDH1A1ATMTSHRNPC1
SCHEMBL18117491 0.86 ATM (0.53) POLBALDH1A1ATMNPC1KDM4E
SCHEMBL973238 0.83 ATM (0.47) ATMDHODH
SCHEMBL28350646 0.83 KMT2A (0.43) POLBKDM4EDHODH
SCHEMBL972255 0.83 EGFR (0.48) SMN1; SMN2DHODH
SCHEMBL3685890 0.82 HTT (0.43) KDM4EDHODH
SCHEMBL4930458 0.81 RAB9A (0.50) POLBALDH1A1ATMNAMPTNPC1
SCHEMBL18106786 0.81 LMNA (0.48) ALDH1A1NAMPTNPC1SMN1; SMN2MAPT
SCHEMBL18117492 0.81 ATM (0.48) POLBALDH1A1ATMNPC1SMN1; SMN2
SCHEMBL22029381 0.81 ALDH1A1 (0.53) ALDH1A1NAMPTNPC1KDM4ESMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3677572-B1 PRODUCTION METHOD FOR PYRAZOLE-4-CARBOXAMIDE DERIVATIVE JAPAN FINECHEM COMPANY INC (JP) 2023-06-07 EP disclosed
EP-3677572-A1 PRODUCTION METHOD FOR PYRAZOLE-4-CARBOXAMIDE DERIVATIVE Japan Finechem Company, Inc. (JP) 2020-07-08 EP disclosed
US-20200181091-A1 PRODUCTION METHOD FOR PYRAZOLE-4-CARBOXAMIDE DERIVATIVE JAPAN FINECHEM COMPANY, INC. (JP) 2020-06-11 US disclosed
CN-110891940-A Process for preparing pyrazole-4-carboxamide derivatives 日本凡凯姆股份有限公司 2020-03-17 CN 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 (1 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-20200181091-A1 PRODUCTION METHOD FOR PYRAZOLE-4-CARBOXAMIDE DERIVATIVE AADAC, CYP3A4, ABAT POLB 2215/4885ALDH1A1 412/4885ATM 2430/4885

“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.