SCHEMBL10149523

SCHEMBL10149523

Nc1cc(-c2cc(N)c3ccccn23)ccc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.46
FNTA P49354 3/20 0.43
FNTB P49356 3/20 0.43
IDO1 P14902 1/20 0.41
PRF1 P14222 1/20 0.39
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 2/20 0.39
GFER P55789 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RORC P51449 5/20 0.38
PTGS2 P35354 2/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HNF4A P41235 1/20 0.36
ACMSD Q8TDX5 1/20 0.36
MEN1 O00255 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
SCHEMBL10149522 0.86 FNTA (0.39) PPM1BFNTAFNTBIDO1KDM4E
SCHEMBL343003 0.85 PPM1B (0.40) PPM1BFNTAFNTBIDO1PRF1
SCHEMBL27843160 0.74 FNTA (0.58) FNTAFNTBKDM4EKMT2AALDH1A1
SCHEMBL30456877 0.73 PPM1B (0.71) PPM1BIDO1KDM4EKMT2AGFER
SCHEMBL2575452 0.73 PPM1B (0.71) PPM1BIDO1KDM4EKMT2AGFER
SCHEMBL710309 0.73 PPM1B (0.75) PPM1BIDO1PRF1KDM4EKMT2A
SCHEMBL29436316 0.73 PPM1B (0.75) PPM1BIDO1PRF1KDM4EKMT2A
SCHEMBL23499274 0.71 PPM1B (0.79) PPM1BIDO1PRF1KDM4EKMT2A
SCHEMBL29908977 0.71 PPM1B (0.79) PPM1BIDO1PRF1KDM4EKMT2A
SCHEMBL30898594 0.70 PPM1B (0.47) PPM1BIDO1PRF1KDM4EKMT2A

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
EP-2415771-A1 INDOLIZINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES Kissei Pharmaceutical Co., Ltd. (JP) 2012-02-08 EP disclosed