SCHEMBL10830002

SCHEMBL10830002

Cc1ccc(O)c(C(=O)C=Cc2ccc(N(C)C)cc2)c1

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.76
KMT2A Q03164 4/20 0.76
MAPK1 P28482 3/20 0.76
NPC1 O15118 3/20 0.76
MEN1 O00255 2/20 0.76
TDP1 Q9NUW8 2/20 0.76
L3MBTL1 Q9Y468 2/20 0.76
MAOA P21397 7/20 0.70
MAOB P27338 7/20 0.70
RAB9A P51151 3/20 0.70
HTT P42858 1/20 0.60
CHRNA7 P36544 1/20 0.57
ALDH1A1 P00352 1/20 0.57
GAA P10253 1/20 0.57
ATM Q13315 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CRHBP P24387 1/20 0.57
CRHR2 Q13324 1/20 0.57
TLR9 Q9NR96 1/20 0.57

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
SCHEMBL25196813 0.90 MAOB (0.82) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL30260447 0.86 MAPT (1.00) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL10830716 0.86 MAPT (1.00) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL25016354 0.86 MAPT (1.00) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL4694194 0.86 NFE2L2 (0.69) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL4694196 0.86 NFE2L2 (0.69) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL5437092 0.82 MAOB (0.86) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL25194887 0.82 MAPT (1.00) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL30277220 0.82 MAPT (1.00) MAPTKMT2AMAPK1NPC1MEN1
SCHEMBL30383370 0.82 MAPT (1.00) MAPTKMT2AMAPK1NPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4571409-A ANTIARRHYTHMIA AGENTS BASF AKTIENGESELLSCHAFT (DE) 1986-02-18 US disclosed
EP-0075207-B1 AMINOPROPANOL DERIVATIVES OF 2-HYDROXY-BETA-PHENYL PROPIOPHENONES, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC AGENTS CONTAINING THEM BASF Aktiengesellschaft (DE) 1986-02-05 EP disclosed
US-4540697-A ANTIARRHYTHMIA AGENTS BASF AKTIENGESELLSCHAFT (DE) 1985-09-10 US disclosed