SCHEMBL29643294

SCHEMBL29643294

NC(=O)c1cc(Cl)ccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.54
▸ MAPT P10636 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ KDM4C Q9H3R0 1/20 0.50
▸ LMNA P02545 1/20 0.47
▸ MAP4K4 O95819 1/20 0.46
▸ ADORA3 P0DMS8 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ MC4R P32245 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ MC3R P41968 1/20 0.45
▸ RAB9A P51151 4/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ PARP1 P09874 1/20 0.44
▸ SIRT6 Q8N6T7 1/20 0.44
▸ CCNC P24863 1/20 0.42
▸ CDK8 P49336 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42

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
SCHEMBL106390 1.00 ALDH1A1 (0.54) ALDH1A1MAPTL3MBTL1KDM4CLMNA
Hydrochloric Acid SCHEMBL27262522 0.98 ALDH1A1 (0.53) ALDH1A1MAPTL3MBTL1KDM4CLMNA
Trifluoroacetic Acid SCHEMBL16318459 0.88 L3MBTL1 (0.46) ALDH1A1MAPTL3MBTL1KDM4CLMNA
SCHEMBL27715023 0.83 ALDH1A1 (0.58) ALDH1A1MAPTL3MBTL1KDM4CRAB9A
SCHEMBL27513588 0.82 GRM4 (0.49) ALDH1A1MAPTL3MBTL1LMNATSHR
SCHEMBL177940 0.81 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1KDM4CRAB9A
SCHEMBL31151693 0.81 ALDH1A1 (0.61) ALDH1A1MAPTL3MBTL1KDM4CLMNA
SCHEMBL202448 0.81 ALDH1A1 (0.61) ALDH1A1MAPTL3MBTL1KDM4CLMNA
SCHEMBL31607215 0.81 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1KDM4CRAB9A
SCHEMBL27817832 0.80 ALDH1A1 (0.47) ALDH1A1MAPTL3MBTL1KDM4CLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120082897-A Preparation method for electrochemically synthesizing N-substituted pyridine-2-formamide 九洲药业(杭州)有限公司 2025-06-03 — — CN disclosed
CN-115974774-B Preparation method and application of chloropicolinic acid 利尔化学股份有限公司 2024-09-03 — — CN disclosed
WO-2022057164-A1 PREPARATION METHOD FOR MULTI-TARGET ANTI-TUMOR DRUG 广州南鑫药业有限公司 2022-03-24 — — WO disclosed
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