SCHEMBL7969192

SCHEMBL7969192

Cc1cc(C(C)(CCC(C)(c2cc(C)c(O)c(Br)c2)c2cc(C)c(O)c(Br)c2)c2cc(C)c(O)c(Br)c2)cc(Br)c1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.59
CYP2C9 P11712 4/20 0.59
HIF1A Q16665 3/20 0.59
HSD17B10 Q99714 3/20 0.59
CYP3A4 P08684 3/20 0.52
ALOX15 P16050 2/20 0.52
ALOX12 P18054 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 1/20 0.52
CASP1 P29466 1/20 0.52
RECQL P46063 1/20 0.52
CHEK1 O14757 1/20 0.44
DAPK3 O43293 1/20 0.44
RET P07949 1/20 0.44
PDGFRB P09619 1/20 0.44
PIM1 P11309 1/20 0.44
PDGFRA P16234 1/20 0.44
KDR P35968 1/20 0.44
MAPK8 P45983 1/20 0.44

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
SCHEMBL5953180 0.94 CYP2C9 (0.62) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL9717851 0.90 CYP2C9 (0.50) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL7972245 0.85 ESR1 (0.54) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL14760247 0.83 ALOX15 (0.54) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL30443132 0.81 TSHR (0.78) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL2476258 0.81 TSHR (0.58) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL297739 0.81 TSHR (0.78) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL6232503 0.80 TSHR (0.64) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL9006029 0.79 TSHR (0.58) TSHRCYP2C9HIF1AHSD17B10CYP3A4
SCHEMBL28454013 0.79 HSD17B10 (0.58) TSHRCYP2C9HIF1AHSD17B10CYP3A4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6268462-B1 Branched polycarbonate resin and process for the preparation thereof IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-07-31 US disclosed
EP-1008608-A1 BRANCHED POLYCARBONATE RESIN AND PROCESS FOR THE PREPARATION THEREOF IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2000-06-14 EP disclosed
US-4415725-A MOLDING MATERIALS; BLOW MOLDING; BOTTLES; FILMS GENERAL ELECTRIC CO. (US) 1983-11-15 US disclosed