SCHEMBL27963175

SCHEMBL27963175

O=COC(Cc1ccc(Cl)nc1)Cc1cc(-c2ccccc2)n[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.38
▸ CYP11B2 P19099 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MME P08473 5/20 0.36
▸ MAPT P10636 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2A6 P11509 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2B6 P20813 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ TERT O14746 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ CHRNA7 P36544 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ADORA2B P29275 1/20 0.33
▸ ADORA1 P30542 1/20 0.33

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
SCHEMBL27963119 0.85 LMNA (0.45) CYP11B1CYP11B2LMNAMMEL3MBTL1
SCHEMBL27963122 0.83 MME (0.42) LMNAMMEMAPTRAB9A
SCHEMBL27963121 0.81 MAPT (0.42) MMEMAPTL3MBTL1TP53POLB
SCHEMBL27963148 0.79 MAPT (0.39) CYP11B1CYP11B2LMNAMMEMAPT
SCHEMBL27657760 0.74 MAPT (0.40) LMNAMMEMAPTGAATP53
SCHEMBL27963156 0.73 MAPT (0.53) LMNAMMEMAPTGAACYP2C9
SCHEMBL27809130 0.73 ALDH1A1 (0.35) MAPTL3MBTL1KDM4EGAARAB9A
SCHEMBL27815832 0.72 MAPT (0.37) LMNAMMEMAPTGAAADORA3
SCHEMBL27815972 0.72 LMNA (0.38) CYP11B1CYP11B2LMNAMMEMAPT
SCHEMBL28014533 0.70 CYP2D6 (0.37) CYP11B1CYP11B2LMNAMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103787976-A 1-aryl-3-aryl-1H-pyrromonazole-5-hydroximic acid derivative and application thereof UNIV SHANDONG 2014-05-14 — — CN disclosed
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