SCHEMBL8906402

SCHEMBL8906402

CC(=O)Nc1cccc2c(O)c(C(=O)O)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
LDHA P00338 1/20 0.47
HPGD P15428 4/20 0.46
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 4/20 0.46
MAPT P10636 1/20 0.46
POLB P06746 1/20 0.45
CYP2C19 P33261 1/20 0.45
GPR35 Q9HC97 1/20 0.45
CDC25B P30305 1/20 0.44
HSD17B10 Q99714 3/20 0.44
THRB P10828 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44
ATIC P31939 1/20 0.44
CASP6 P55212 1/20 0.43
PARP14 Q460N5 2/20 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
SCHEMBL16704331 0.85 LDHA (0.43) KMT2AMEN1LDHAHPGDKDM4E
SCHEMBL8745109 0.83 POLB (0.54) KMT2AMEN1RXFP1HPGDKDM4E
SCHEMBL4290828 0.82 KDM4E (0.59) KMT2AMEN1HPGDKDM4EALDH1A1
SCHEMBL1900214 0.81 RXFP1 (0.66) KMT2AMEN1RXFP1HPGDKDM4E
SCHEMBL14557451 0.81 MAPT (0.48) KMT2AMEN1LDHAHPGDKDM4E
SCHEMBL10957416 0.81 ALDH1A1 (0.51) KMT2AMEN1RXFP1LDHAHPGD
SCHEMBL7014176 0.79 KMT2A (0.49) KMT2AMEN1RXFP1HPGDKDM4E
SCHEMBL8026725 0.79 KMT2A (0.49) KMT2AMEN1RXFP1HPGDKDM4E
SCHEMBL5351442 0.79 PARP14 (0.54) KMT2AMEN1RXFP1HPGDKDM4E
SCHEMBL8906833 0.79 EP300 (0.53) KMT2ALDHAHPGDKDM4ECDC25B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5612173-A INDOPHENOL DYE EASTMAN KODAK COMPANY (US) 1997-03-18 US disclosed
EP-0574090-A1 One equivalent couplers and low pKa release dyes EASTMAN KODAK COMPANY (US) 1993-12-15 EP disclosed