SCHEMBL11769985

SCHEMBL11769985

COCCCNC(=O)Nc1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 4/20 0.56
▸ POLB P06746 1/20 0.56
▸ KMT2A Q03164 9/20 0.55
▸ MEN1 O00255 8/20 0.55
▸ MAPT P10636 6/20 0.55
▸ SMN1; SMN2 Q16637 5/20 0.55
▸ HPGD P15428 3/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ LMNA P02545 3/20 0.55
▸ ALDH1A1 P00352 6/20 0.54
▸ NPSR1 Q6W5P4 2/20 0.54
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ CNR1 P21554 1/20 0.50
▸ ACHE P22303 1/20 0.48
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ MYOC Q99972 1/20 0.47

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
SCHEMBL11768979 0.93 HTT (0.58) HTTPOLBKMT2AMEN1MAPT
SCHEMBL11766345 0.89 KMT2A (0.56) HTTPOLBKMT2AMEN1MAPT
SCHEMBL11766882 0.87 KMT2A (0.65) HTTPOLBKMT2AMEN1MAPT
SCHEMBL11768631 0.85 MEN1 (0.60) HTTPOLBKMT2AMEN1MAPT
SCHEMBL11770038 0.84 KMT2A (0.68) HTTPOLBKMT2AMEN1MAPT
SCHEMBL11768427 0.81 MEN1 (0.67) HTTPOLBKMT2AMEN1MAPT
SCHEMBL6939392 0.79 MEN1 (0.79) HTTPOLBKMT2AMEN1MAPT
SCHEMBL11768264 0.77 MEN1 (0.69) HTTPOLBKMT2AMEN1MAPT
SCHEMBL27929224 0.77 HTT (0.66) HTTPOLBKMT2AMEN1MAPT
SCHEMBL11768574 0.77 MEN1 (0.58) HTTPOLBKMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3970752-A Coccidiocidal compositions utilizing 1-phenyl-substituted 1,3,5-triazine BAYER AKTIENGESELLSCHAFT (DT) 1976-07-20 — — US disclosed
US-3948893-A COCCIDIOSIS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-06 — — US disclosed
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