SCHEMBL4395867

SCHEMBL4395867

CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.46
ALDH1A1 P00352 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
LMNA P02545 2/20 0.35
SNCA P37840 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TP53 P04637 1/20 0.32
ESR1 P03372 1/20 0.32
AOC3 Q16853 1/20 0.32
TAAR1 Q96RJ0 2/20 0.31
KDM4E B2RXH2 1/20 0.31
TRPA1 O75762 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL29563765 0.86 HIF1A (0.60) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL28516067 0.84 ACHE (0.35) HIF1AALDH1A1CYP1A2CYP2D6TSHR
Fluoride Ion SCHEMBL584733 0.84 HIF1A (0.57) HIF1AALDH1A1CYP1A2CYP2D6TSHR
Water SCHEMBL3419223 0.84 HIF1A (0.57) HIF1AALDH1A1CYP1A2CYP2D6TSHR
Iodide SCHEMBL41863 0.84 HIF1A (0.57) HIF1AALDH1A1CYP1A2CYP2D6TSHR
Iodide SCHEMBL10592900 0.84 HIF1A (0.57) HIF1AALDH1A1CYP1A2CYP2D6TSHR
Bromide SCHEMBL42887 0.84 HIF1A (0.57) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL9513351 0.84 HIF1A (0.57) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL9513348 0.84 HIF1A (0.57) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL29967015 0.84 HIF1A (0.57) HIF1AALDH1A1CYP1A2CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629431-B2 Polycarbonate prepolymer for solid phase polymerization and process for producing polycarbonate IDEMITSU KOSAN CO., LTD. (JP) 2009-12-08 US disclosed
US-7390868-B2 Catalyst for polycarbonate production and process for producing polycarbonate NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-06-24 US disclosed
US-20080064847-A1 Oxidative carbonylation; molecular weight control IDEMISU KOSAN CO., LTD. (JP) 2008-03-13 US disclosed
US-20070043199-A1 Catalyst for polycarbonate production and process for producing polycarbonate IDEMITSU KOSAN CO., LTD. (JP) 2007-02-22 US disclosed
US-5922826-A TRANSESTERIFICATION IN PRESENCE OF A POLYMERIZATION CATALYST CONTAINING AN ORGANONITROGEN COMPOUND AND A QUATERNARY PHOSPHONIUM SALT TO PRODUCE POLYCARBONATE IDEMITSU KOSAN CO., LTD. (JP) 1999-07-13 US disclosed
EP-0807657-A1 PROCESS FOR PRODUCING POLYCARBONATE IDEMITSU KOSAN COMPANY LIMITED (JP) 1997-11-19 EP disclosed
US-4965657-A BROMINATED EPOXY RESIN, ANTIMONY OXIDE, AND QUATERNARY PHOSPHONIUM TETRASUBSTITUTED BORATE HITACHI LTD. (JP) 1990-10-23 US disclosed