SCHEMBL383673

SCHEMBL383673

C[P+](C)(C)c1ccccc1.C[P+](C)(C)c1ccccc1.[O-]B([O-])F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.35
TDP1 Q9NUW8 1/20 0.32
CTRB1 P17538 2/20 0.31
TAAR1 Q96RJ0 4/20 0.30
SLC6A2 P23975 2/20 0.30
MAOA P21397 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
CYP2A6 P11509 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL7934982 0.85 HIF1A (0.35) HIF1ATDP1CTRB1TAAR1SLC6A2
SCHEMBL9635314 0.85 HIF1A (0.35) HIF1ATDP1CTRB1TAAR1SLC6A2
SCHEMBL7877206 0.84 HIF1A (0.41) HIF1ATDP1TAAR1SLC6A2MAOA
SCHEMBL30596201 0.84 HIF1A (0.45) HIF1ATDP1TAAR1SLC6A2MAOA
SCHEMBL7179666 0.83 HIF1A (0.33) HIF1ATDP1MAOA
Phenol SCHEMBL7874538 0.82 HIF1A (0.36) HIF1ATDP1TAAR1SLC6A2MAOA
SCHEMBL7175373 0.81 HIF1A (0.32) HIF1ATDP1
Fluoride Ion SCHEMBL1961963 0.81 HIF1A (0.43) HIF1ATDP1TAAR1SLC6A2MAOA
Water SCHEMBL1067231 0.81 HIF1A (0.43) HIF1ATDP1TAAR1SLC6A2MAOA
Iodide SCHEMBL5087524 0.81 HIF1A (0.43) HIF1ATDP1TAAR1SLC6A2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2718448-A2 METHODS FOR TREATING LIGNOCELLULOSIC MATERIAL Syngenta Participations AG (CH) 2014-04-16 EP disclosed
WO-2012168410-A2 METHODS FOR TREATING LIGNOCELLULOSIC MATERIAL SYNGENTA PARTICIPATIONS AG (CH) 2012-12-13 WO disclosed
EP-2439208-A1 Method of preparing organometallic compounds Rohm and Haas Company (US) 2012-04-11 EP disclosed
US-8101787-B2 Method of preparing organometallic compounds ROHM AND HAAS COMPANY (US) 2012-01-24 US disclosed
EP-2359923-A1 Method of preparing organometallic compounds Rohm and Haas Company (US) 2011-08-24 EP disclosed
EP-2359922-A1 Method of preparing organometallic compounds Rohm and Haas Company (US) 2011-08-24 EP disclosed
US-20110172452-A1 Method of Preparing Organometallic Compounds ROHM AND HAAS COMPANY (US) 2011-07-14 US disclosed
US-7939684-B2 Method of preparing organometallic compounds ROHM AND HAAS COMPANY (US) 2011-05-10 US disclosed
US-7919638-B2 Method of preparing organometallic compounds ROHM AND HAAS COMPANY (US) 2011-04-05 US disclosed
US-20100185003-A1 Method of Preparing Organometallic Compounds ROHM AND HAAS COMPANY (US) 2010-07-22 US disclosed
US-20100185002-A1 Method of Preparing Organometallic Compounds ROHM AND HAAS COMPANY (US) 2010-07-22 US disclosed
US-7659414-B2 Method of preparing organometallic compounds ROHM AND HAAS COMPANY (US) 2010-02-09 US disclosed
EP-2020258-A2 Method Of Preparing Organometallic Compounds Rohm and Haas Company (US) 2009-02-04 EP disclosed
US-20090023940-A1 Method of preparing organometallic compounds ROHM AND HAAS COMPANY 2009-01-22 US disclosed