SCHEMBL10757707

SCHEMBL10757707

Cc1cccc([N+](=O)[O-])c1C=C1C(=O)NC(=O)N1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.44
▸ MEN1 O00255 6/20 0.44
▸ MAPT P10636 6/20 0.44
▸ KDM4E B2RXH2 4/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ TSHR P16473 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ RECQL P46063 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ XDH P47989 2/20 0.39
▸ TDP1 Q9NUW8 5/20 0.39
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ DNMT1 P26358 1/20 0.38
▸ LMNA P02545 1/20 0.37

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
SCHEMBL10757702 1.00 KMT2A (0.44) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL10762108 0.84 KMT2A (0.44) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL10762105 0.84 KMT2A (0.44) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL3026114 0.77 HTT (0.34) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL3026110 0.77 HTT (0.34) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL3026542 0.76 TDP1 (0.34) KMT2AMAPTKDM4EALDH1A1MAPK1
SCHEMBL3026544 0.76 TDP1 (0.34) KMT2AMAPTKDM4EALDH1A1MAPK1
SCHEMBL10759390 0.76 KMT2A (0.52) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL10759394 0.76 KMT2A (0.52) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL3010317 0.75 ALDH1A1 (0.35) KMT2AMEN1MAPTKDM4EALDH1A1

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
US-4668686-A 1,3-DIHYDRO-2H-IMIDAZO/4,5-B/QUINOLINE-2-ONES BRISTOL-MYERS COMPANY (US) 1987-05-26 — — US disclosed
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