SCHEMBL3252256

SCHEMBL3252256

CON(c1ccccc1)S(=O)(=O)c1ccc2[nH]c(=O)c3[nH]cc(C(=O)O)c3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
HSD17B10 Q99714 5/20 0.44
KDM4E B2RXH2 4/20 0.44
HPGD P15428 4/20 0.44
USP2 O75604 1/20 0.44
ESR1 P03372 1/20 0.44
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
ADRB2 P07550 1/20 0.42
RECQL P46063 1/20 0.42
POLB P06746 6/20 0.40
TDP1 Q9NUW8 3/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 4/20 0.39
TP53 P04637 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALPL P05186 1/20 0.37
ALPI P09923 1/20 0.37

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
SCHEMBL3255494 0.89 MAPT (0.44) MAPTHSD17B10KDM4EHPGDUSP2
SCHEMBL3250548 0.87 HPGD (0.56) MAPTHSD17B10KDM4EHPGDUSP2
SCHEMBL3248232 0.84 HSD17B10 (0.47) MAPTHSD17B10KDM4EHPGDUSP2
SCHEMBL3251841 0.81 MAPT (0.51) MAPTHSD17B10KDM4EHPGDUSP2
SCHEMBL3247194 0.80 HPGD (0.48) MAPTHSD17B10KDM4EHPGDKMT2A
SCHEMBL3244949 0.80 HSD17B10 (0.55) HSD17B10KDM4EHPGDKMT2AMEN1
SCHEMBL4760872 0.79 ALDH1A1 (0.50) MAPTHSD17B10KDM4EHPGDUSP2
SCHEMBL3242740 0.79 HPGD (0.48) HSD17B10KDM4EHPGDKMT2AMEN1
SCHEMBL3248331 0.79 KDM4E (0.60) MAPTHSD17B10KDM4EHPGDUSP2
SCHEMBL3249438 0.79 PTPN11 (0.45) MAPTHSD17B10KDM4EHPGDUSP2

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
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP disclosed