SCHEMBL9022977

SCHEMBL9022977

N#Cc1c(C(=O)c2ccc(Cl)cc2)n(O)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 1/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ STAT3 P40763 1/20 0.40
▸ MAPT P10636 3/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ RORC P51449 1/20 0.38
▸ NR4A1 P22736 1/20 0.38

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
SCHEMBL9022394 0.89 ALDH1A1 (0.47) CCR2KMT2AALDH1A1MAPK1STAT3
SCHEMBL9023297 0.86 ALDH1A1 (0.46) KMT2AALDH1A1MAPK1STAT3MAPT
SCHEMBL9022784 0.86 KMT2A (0.57) CCR2KMT2AALDH1A1MAPK1STAT3
SCHEMBL9022956 0.86 CCR2 (0.54) CCR2KMT2AALDH1A1MAPK1STAT3
SCHEMBL9023337 0.84 ALDH1A1 (0.43) CCR2KMT2AALDH1A1MAPK1NPSR1
SCHEMBL9022716 0.83 HTT (0.44) KMT2AALDH1A1MAPK1MAPTNPSR1
SCHEMBL9022796 0.75 CNR2 (0.45) ALDH1A1LMNAPOLB
SCHEMBL9022343 0.73 ALDH1A1 (0.46) CCR2KMT2AALDH1A1MAPK1STAT3
SCHEMBL9023167 0.73 PGR (0.45) KMT2AALDH1A1MAPK1STAT3MAPT
SCHEMBL8402112 0.68 MAPT (0.47) KMT2AALDH1A1MAPK1MAPTNPSR1

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
EP-0470665-B1 1-Hydroxyindole fungicides EASTMAN KODAK CO (US) 1996-04-24 — — EP disclosed
US-5118695-A 1-HYDROXYINDOLE FUNGICIDES EASTMAN KODAK COMPANY (US) 1992-06-02 — — US disclosed
EP-0470665-A1 1-Hydroxyindole fungicides EASTMAN KODAK COMPANY (US) 1992-02-12 — — EP disclosed
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