SCHEMBL2107971

SCHEMBL2107971

Cc1cnccc1NC(=O)OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.48
CYP17A1 P05093 4/20 0.47
RAB9A P51151 1/20 0.44
METAP1 P53582 1/20 0.41
BRS3 P32247 1/20 0.41
ATR Q13535 1/20 0.41
IL2 P60568 1/20 0.40
BRD9 Q9H8M2 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
SCHEMBL555073 0.88 NAMPT (0.48) NAMPTCYP17A1RAB9AMETAP1ATR
SCHEMBL18522430 0.87 NAMPT (0.50) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL3666785 0.84 NAMPT (0.48) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL15432258 0.83 HPGD (0.49) RAB9AIL2
SCHEMBL16307603 0.83 CYP17A1 (0.55) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL4037373 0.83 NAMPT (0.47) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL15039524 0.83 CYP17A1 (0.55) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL741240 0.83 NAMPT (0.47) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL4827917 0.83 NAMPT (0.47) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL5746021 0.83 NAMPT (0.47) NAMPTCYP17A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250282762-A1 PYRAZOLOPYRIDINE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2025-09-11 US disclosed
WO-2025111547-A1 2,3-DIHYDROPYROLLOPYRIDINE CARBOXAMIDE COMPOUNDS AND METHODS OF USE THEREOF RGENTA THERAPEUTICS, INC. (US) 2025-05-30 WO disclosed
US-20250002479-A1 PYRAZOLOPYRIDINE DERIVATIVES AND USES THEREOF NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2025-01-02 US disclosed
US-12172984-B2 Pyrazolopyridine derivatives and uses thereof NOVARTIS AG (CH) 2024-12-24 US disclosed
US-20230374006-A1 HETEROARYL COMPOUNDS AND USES THEREOF APRINOIA THERAPEUTICS LIMITED (CN) 2023-11-23 US disclosed
US-11806346-B2 HTT modulators for treating Huntington's disease CHDI FOUNDATION, INC. (US) 2023-11-07 US disclosed
US-11806346-B2 HTT modulators for treating Huntington's disease CHDI FOUNDATION, INC. (US) 2023-11-07 US disclosed
US-11806346-B2 HTT modulators for treating Huntington's disease CHDI FOUNDATION, INC. (US) 2023-11-07 US disclosed
US-11787785-B2 Pyrazolopyridine derivatives and uses thereof NOVARTIS AG (CH) 2023-10-17 US disclosed
US-11787785-B2 Pyrazolopyridine derivatives and uses thereof NOVARTIS AG (CH) 2023-10-17 US disclosed
WO-2005032481-A2 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS INC. (US) 2005-04-14 WO disclosed
WO-2004104001-A2 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSHORYLASE PROSIDION LIMITED (GB) 2004-12-02 WO disclosed
EP-0997465-B1 Azaindole derivatives and their use as antithrombotic agents LILLY CO ELI (US) 2004-02-04 EP disclosed
US-6380230-B1 FOR THERAPY OF DYSKINESIA, OBESITY, IRRITABLE BOWEL SYNDROME, DISEASES WHOSE TREATMENT REQUIRES STIMULATION OF THE CHOLECYSTOKININ CCK-A RECEPTORS SANOFI-SYNTHELABO (FR) 2002-04-30 US disclosed
US-6359136-B1 AZAINDOLE COMPOUND ELI LILLY AND COMPANY 2002-03-19 US disclosed
US-6265416-B1 ANTICOAGULANTS ELI LILLY AND COMPANY 2001-07-24 US disclosed
EP-1017693-A1 CARBOXAMIDOTHIAZOLE DERIVATIVES, PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2000-07-12 EP disclosed
EP-0997465-A1 Azaindole derivatives and their use as antithrombotic agents ELI LILLY AND COMPANY (US) 2000-05-03 EP disclosed
WO-1999015525-A1 CARBOXAMIDOTHIAZOLE DERIVATIVES, PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 1999-04-01 WO disclosed
US-5681959-A DEPROTONATION OF A 2-AMINO-3-ALKYLPYRIDINE WITH AN ALKYLLITHIUM COMPOUND, THEN REACTION WITH AN AMIDE OR ESTER AND TREATMENT WITH A CONCENTRATED ACID FOR CYCLIZATION MERCK, SHARP & DOHME LTD. (GB) 1997-10-28 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 (6 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-20230374006-A1 HETEROARYL COMPOUNDS AND USES THEREOF MAPT, APP, SLCO1B3 NAMPT 3012/4885CYP17A1 751/4885RAB9A 603/4885
US-11787785-B2 Pyrazolopyridine derivatives and uses thereof HBZ, ZFX, WIZ NAMPT 3268/4885CYP17A1 4410/4885RAB9A 2816/4885
US-12172984-B2 Pyrazolopyridine derivatives and uses thereof HBZ, ZFX, WIZ NAMPT 3268/4885CYP17A1 4410/4885RAB9A 2816/4885
US-20250282762-A1 PYRAZOLOPYRIDINE DERIVATIVES AND USES THEREOF HBZ, ZFX, WIZ NAMPT 3268/4885CYP17A1 4410/4885RAB9A 2816/4885
US-11806346-B2 HTT modulators for treating Huntington's disease HTT, HYPK, ATXN2 NAMPT 1345/4885CYP17A1 4412/4885RAB9A 1713/4885
US-20250002479-A1 PYRAZOLOPYRIDINE DERIVATIVES AND USES THEREOF HBZ, ZFX, WIZ NAMPT 3268/4885CYP17A1 4410/4885RAB9A 2816/4885

“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.