SCHEMBL8189042

SCHEMBL8189042

COc1cc(Cl)ccc1C(=O)Nc1cccc2c1CCN(C)C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
USP2 O75604 1/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
PPARG P37231 1/20 0.48
PPARD Q03181 1/20 0.48
PPARA Q07869 1/20 0.48
KDM4E B2RXH2 1/20 0.46
KCNMA1 Q12791 1/20 0.46
HIF1A Q16665 1/20 0.46
POLB P06746 2/20 0.46
MAPT P10636 4/20 0.45
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KAT2B Q92831 1/20 0.43
BRD9 Q9H8M2 1/20 0.43
KDR P35968 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL8184303 0.92 MEN1 (0.64) MEN1KMT2ASMN1; SMN2USP2MAPK1
SCHEMBL8176766 0.89 ALDH1A1 (0.50) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL8184601 0.89 KMT2A (0.49) MEN1KMT2ASMN1; SMN2USP2MAPK1
Hydrochloric Acid SCHEMBL8184284 0.88 ALDH1A1 (0.49) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL8175290 0.88 KMT2A (0.48) MEN1KMT2ASMN1; SMN2USP2MAPK1
SCHEMBL7109075 0.87 MAPT (0.50) MEN1KMT2ASMN1; SMN2USP2MAPK1
SCHEMBL8175630 0.86 RAB9A (0.56) MEN1KMT2ASMN1; SMN2USP2MAPK1
SCHEMBL8174345 0.86 SMN1; SMN2 (0.47) MEN1KMT2ASMN1; SMN2USP2MAPK1
SCHEMBL8185113 0.86 MAPK1 (0.47) MEN1KMT2ASMN1; SMN2USP2MAPK1
SCHEMBL8176086 0.86 MAPT (0.45) MEN1KMT2ASMN1; SMN2USP2MAPK1

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-6110934-A Substituted benzamide derivatives and their use as anticonvulsants SMITHKLINE BEECHAM P.L.C. (GB) 2000-08-29 US disclosed