SCHEMBL11770775

SCHEMBL11770775

CCCNC(=O)Nc1ccc(Sc2ccc([N+](=O)[O-])cc2)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.53
▸ MEN1 O00255 6/20 0.53
▸ MAPT P10636 8/20 0.51
▸ LMNA P02545 5/20 0.51
▸ HTT P42858 4/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ HPGD P15428 2/20 0.51
▸ CNR1 P21554 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ PDE7A Q13946 3/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ MAPK1 P28482 1/20 0.46
▸ PDE4B Q07343 1/20 0.46
▸ PDE4D Q08499 1/20 0.46
▸ PDE7B Q9NP56 1/20 0.46
▸ EPHX2 P34913 1/20 0.45
▸ GAA P10253 1/20 0.44
▸ XBP1 P17861 1/20 0.44
▸ RAB9A P51151 1/20 0.44

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
SCHEMBL11770162 0.91 MAPT (0.50) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11768353 0.87 MEN1 (0.53) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11773871 0.87 KMT2A (0.50) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11773276 0.85 PDE7A (0.53) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11770038 0.85 KMT2A (0.68) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11773712 0.85 LMNA (0.48) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11769901 0.85 PDE7A (0.56) KMT2AMEN1MAPTLMNAHTT
SCHEMBL6907398 0.80 POLB (0.72) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11769994 0.79 KMT2A (0.47) KMT2AMEN1MAPTLMNAHTT
SCHEMBL11766209 0.79 PDE7A (0.60) KMT2AMEN1MAPTLMNAHTT

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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