SCHEMBL10762108

SCHEMBL10762108

Cc1ccc([N+](=O)[O-])c(C=C2C(=O)NC(=O)N2C)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 9/20 0.44
▸ MEN1 O00255 6/20 0.44
▸ MAPT P10636 10/20 0.39
▸ KDM4E B2RXH2 4/20 0.39
▸ RECQL P46063 3/20 0.39
▸ ATM Q13315 1/20 0.39
▸ ALDH1A1 P00352 5/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ TDP1 Q9NUW8 4/20 0.38
▸ POLB P06746 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ DNMT1 P26358 1/20 0.38
▸ TSHR P16473 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ GSK3A P49840 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ XDH P47989 2/20 0.34

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
SCHEMBL10762105 1.00 KMT2A (0.44) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10757702 0.84 KMT2A (0.44) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10757707 0.84 KMT2A (0.44) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10753480 0.76 TSHR (0.44) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10753482 0.76 TSHR (0.44) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10755749 0.76 MAPT (0.53) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10755753 0.76 MAPT (0.53) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10754644 0.71 ALDH1A1 (0.47) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10754642 0.71 ALDH1A1 (0.47) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL10759322 0.70 GSK3B (0.36) KMT2AMEN1MAPTKDM4ERECQL

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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