SCHEMBL9717849

SCHEMBL9717849

Cc1cc(C(C)(C)c2cc(C)c(O)c(Br)c2)cc(Br)c1O.Cc1cc(C(C)(C)c2cc(C)c(O)c(Cl)c2)cc(Cl)c1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.62
HSD17B10 Q99714 4/20 0.62
TSHR P16473 4/20 0.62
ALDH1A1 P00352 4/20 0.62
HIF1A Q16665 3/20 0.62
CYP3A4 P08684 3/20 0.62
ALOX12 P18054 2/20 0.62
RECQL P46063 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
HPGD P15428 1/20 0.62
CASP1 P29466 1/20 0.62
CHEK1 O14757 1/20 0.53
DAPK3 O43293 1/20 0.53
RET P07949 1/20 0.53
PDGFRB P09619 1/20 0.53
PIM1 P11309 1/20 0.53
PDGFRA P16234 1/20 0.53
KDR P35968 1/20 0.53
MAPK8 P45983 1/20 0.53
RPS6KA3 P51812 1/20 0.53

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
SCHEMBL1068524 0.89 TSHR (0.72) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL297381 0.89 HSD17B10 (0.46) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL31287202 0.89 HSD17B10 (0.46) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL30443132 0.89 TSHR (0.78) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL297739 0.89 TSHR (0.78) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL9006028 0.87 ALOX15 (0.76) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL16383381 0.87 TSHR (0.83) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL9777080 0.86 CYP3A4 (0.54) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL9717851 0.85 CYP2C9 (0.50) ALOX15HSD17B10TSHRALDH1A1HIF1A
SCHEMBL5953176 0.83 TSHR (0.83) ALOX15HSD17B10TSHRALDH1A1HIF1A

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-0500131-A2 Polycarbonate resin solution for film formation by casting MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1992-08-26 EP disclosed