SCHEMBL28295487

SCHEMBL28295487

CCCCNc1ccccc1C(=O)c1cc(C)ccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 9/20 0.47
▸ HPGD P15428 2/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CNR2 P34972 2/20 0.46
▸ CNR1 P21554 1/20 0.46
▸ KDM6B O15054 1/20 0.46
▸ KDM4C Q9H3R0 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ MAPK8 P45983 1/20 0.46
▸ POLB P06746 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA9 Q16790 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
SCHEMBL28293667 0.91 PLK1 (0.52) PLK1HPGDCYP2C9CNR2CNR1
SCHEMBL28295475 0.88 HPGD (0.55) PLK1HPGDCYP2C9CNR2CNR1
SCHEMBL28650424 0.86 APEX1 (0.50) PLK1HPGDCYP2C9CNR2CNR1
SCHEMBL28293669 0.86 PLK1 (0.54) PLK1KDM6BKDM4C
SCHEMBL993102 0.82 HPGD (0.65) PLK1HPGDCYP2C9CNR2KDM6B
SCHEMBL9824061 0.81 PLK1 (0.64) PLK1KDM6BKDM4C
SCHEMBL28655003 0.80 KDM4E (0.53) HPGDCYP2C9CNR2CNR1KDM6B
SCHEMBL28109945 0.80 PLK1 (0.67) PLK1
SCHEMBL9279131 0.78 KMT2A (0.56) PLK1HPGDCYP2C9CNR2CNR1
SCHEMBL466141 0.78 PLK1 (0.63) PLK1HPGDCYP2C9CNR2CNR1

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
CN-109651179-B 2- (2-aminobenzoyl) benzoic acid derivatives and process for preparing the same 厦门华厦学院 2021-12-03 — — CN disclosed
CN-109651179-A 2- (2- amino benzoyl) benzoic acid derivative and preparation method thereof 厦门华厦学院 2019-04-19 — — CN disclosed
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