SCHEMBL11543786

SCHEMBL11543786

Cc1cccc(N(C)c2ccc(C=O)c(O)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
TYR P14679 2/20 0.41
ALDH1A1 P00352 2/20 0.41
TRIM24 O15164 2/20 0.41
TRIM33 Q9UPN9 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 2/20 0.39
EGFR P00533 2/20 0.39
CSF1R P07333 2/20 0.39
HSD17B1 P14061 2/20 0.38
HSD17B2 P37059 2/20 0.38
ERN1 O75460 3/20 0.37
POLB P06746 2/20 0.36
SIGMAR1 Q99720 1/20 0.36
KDM4C Q9H3R0 1/20 0.36

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
SCHEMBL11537712 0.86 TYR (0.45) KDM4EMAPTTYRALDH1A1TRIM24
SCHEMBL11443303 0.86 TRIM24 (0.46) KDM4EMAPTTYRALDH1A1TRIM24
SCHEMBL17521501 0.78 CYP2A6 (0.50) ALDH1A1MEN1TP53HPGDKMT2A
SCHEMBL29446225 0.77 TYR (0.52) KDM4EMAPTTYRALDH1A1TRIM24
SCHEMBL1001895 0.77 TYR (0.52) KDM4EMAPTTYRALDH1A1TRIM24
SCHEMBL1697445 0.76 ACHE (0.55) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL11296596 0.76 TYR (0.66) MAPTTYRALDH1A1TRIM24TRIM33
SCHEMBL6875954 0.75 ACHE (0.48) ALDH1A1MEN1TP53KMT2ASMN1; SMN2
SCHEMBL225766 0.74 TYR (0.57) KDM4EMAPTTYRALDH1A1TRIM24
SCHEMBL29953108 0.74 TYR (0.57) KDM4EMAPTTYRALDH1A1TRIM24

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-4147509-A SUBSTRATE COATED WITH A DYE-FORMING COMPONENT AND A BINDER BASF AKTIENGESELLSCHAFT (DE) 1979-04-03 US disclosed