SCHEMBL3188266

SCHEMBL3188266

c1ccc(C[P](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.44
CALM1 P0DP23 1/20 0.43
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
TSHR P16473 4/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX2 P34913 1/20 0.40
IDO1 P14902 1/20 0.39
TP53 P04637 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
TRPA1 O75762 1/20 0.39
MAOB P27338 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
CASP1 P29466 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CFTR P13569 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
Hydrochloric Acid SCHEMBL25296192 0.97 HPGD (0.43) HPGDCALM1CYP3A4CYP2C19TSHR
SCHEMBL28404206 0.91 HPGD (0.39) HPGDCALM1CYP3A4CYP2C19TSHR
SCHEMBL28471292 0.84 PLA2G1B (0.40) ALDH1A1KMT2AIDO1LOXL2MAOB
Bromide SCHEMBL29282635 0.82 ALDH1A1 (0.40) HPGDCYP3A4CYP2C19TSHRALDH1A1
Hydrochloric Acid SCHEMBL29282636 0.82 SIGMAR1 (0.42) HPGDCYP2C19TSHRMEN1KMT2A
SCHEMBL25295182 0.79 TSHR (0.48) TSHRMEN1KMT2ALOXL2MAOB
Hydrochloric Acid SCHEMBL28832494 0.76 HPGD (0.43) HPGDCALM1CYP3A4CYP2C19TSHR
SCHEMBL11466763 0.74 HTT (0.50) HPGDCALM1CYP3A4CYP2C19TSHR
SCHEMBL518265 0.74 CYP3A4 (0.68) HPGDCYP3A4CYP2C19ALDH1A1MEN1
SCHEMBL11175982 0.74 HPGD (0.52) HPGDCYP3A4CYP2C19ALDH1A1MEN1

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 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101772490-B Trazodone and trazodone hydrochloride in purified form ACRAF 2013-11-06 CN claimed
CN-103068906-A Fluorine-containing elastomer composition and molded article DAIKIN IND LTD 2013-04-24 CN claimed
CN-101772490-A Trazodone and trazodone hydrochloride in purified form ACRAF 2010-07-07 CN claimed
CN-101541882-A Fluoropolymer compositions comprising dual cure hydrotalcite 3M INNOVATIVE PROPERTIES CO (US) 2009-09-23 CN claimed
CN-100436454-C Novel harringtonlne derivative, method for making same and its pharmaceutical composition and use thereof CHINESE ACAD MED SCIENCE (CN) 2008-11-26 CN claimed
CN-1463975-A Novel harringtonlne derivative, method for making same and its pharmaceutical composition and use thereof CHINESE ACAD MED SCIENCE (CN) 2003-12-31 CN claimed
CN-106678368-A Coal mill inserting plate door sealing part and sealing structure 马鞍山中力密封科技有限公司 2017-05-17 CN disclosed
CN-101495312-B Composition, article, its manufacture and use HEIDELBERG ASIA PROCUREMENT CT 2014-08-20 CN disclosed
CN-101535277-B Crystalline forms of 2-chloro-5- [3, 6-dihydro-3-methyl-2, 6-dioxo-4- (trifluoromethyl) -1- (2H) -pyrimidinyl ] -4-fluoro-N- [ [ methyl (1-methylethyl) amino ] sulfonyl ] benzamide BASF SE 2014-06-25 CN disclosed
CN-103534647-A Photosensitive resin composition for forming biochip, and biochip NAT UNIV CORP KYOTO UNIV 2014-01-22 CN disclosed
CN-101772490-B Trazodone and trazodone hydrochloride in purified form ACRAF 2013-11-06 CN disclosed
CN-103370306-A Glucagon receptor modulators PFIZER 2013-10-23 CN disclosed
CN-103068906-A Fluorine-containing elastomer composition and molded article DAIKIN IND LTD 2013-04-24 CN disclosed
CN-1291219-A Resin composition for powder coating NISSAN CHEMICAL IND LTD (JP) 2001-04-11 CN disclosed
CN-1260802-A 20-aralkyl-5 'alpha'-pregnane derivatives AKZO NOBEL NV (NL) 2000-07-19 CN disclosed
CN-1192746-A Peptide derivatives and angiotensin IV receptor agonists SAGAMI CHEM RES (JP) 1998-09-09 CN disclosed
CN-1169994-A Xanthine compounds having terminally aminated alkynol side chains HOECHST AG (DE) 1998-01-14 CN disclosed
CN-1072193-A The polymer blend that contains the  compound DOW CHEMICAL CO (US) 1993-05-19 CN disclosed
CN-1016336-B Olefines pesticide composition and preparation method thereof ICI PLC (GB) 1992-04-22 CN disclosed
CN-86106692-A Olefines as sterilant 1987-03-18 CN disclosed