SCHEMBL10913630

SCHEMBL10913630

Cc1ccc(-n2cc(OC(=O)O)c(=O)c3cc(F)c(F)c(F)c32)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 2/20 0.48
POLB P06746 1/20 0.48
HSP90AA1 P07900 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
STAT3 P40763 3/20 0.43
HTT P42858 2/20 0.40
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TP53 P04637 1/20 0.38
PIM1 P11309 3/20 0.37
MAPT P10636 1/20 0.37
RORC P51449 1/20 0.35
TOP1 P11387 1/20 0.35

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
SCHEMBL6213803 0.90 ALDH1A1 (0.50) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL6214790 0.90 KDM4E (0.49) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL10912940 0.88 ALDH1A1 (0.48) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL10911343 0.87 ALDH1A1 (0.54) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL9868878 0.85 ALDH1A1 (0.64) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL6215098 0.85 PIM1 (0.43) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL10915726 0.84 ALDH1A1 (0.49) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL10915439 0.83 HPGD (0.47) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL10915500 0.83 ALDH1A1 (0.48) ALDH1A1KDM4EPOLBHSP90AA1RXFP1
SCHEMBL10914437 0.82 HPGD (0.45) ALDH1A1KDM4EPOLBHSP90AA1RXFP1

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-0201829-A1 1-Aryl-4-quinolone-3-carboxylic acids BAYER AG (DE) 1986-11-20 EP disclosed