SCHEMBL1129629

SCHEMBL1129629

SCCc1ccccc1-c1cccnc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 4/20 0.56
FOLH1 Q04609 4/20 0.51
KCNH2 Q12809 2/20 0.50
CYP11B1 P15538 4/20 0.49
CYP11B2 P19099 3/20 0.49
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 2/20 0.47
TSHR P16473 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2A6 P11509 2/20 0.47
CYP1A2 P05177 1/20 0.47
ADRA2C P18825 1/20 0.44
PTGS2 P35354 1/20 0.43
MKNK1 Q9BUB5 1/20 0.42
MKNK2 Q9HBH9 1/20 0.42
CYP2E1 P05181 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL1130345 0.86 KCNA5 (0.59) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL13818792 0.83 KCNA5 (0.56) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL10587560 0.83 KCNA5 (0.56) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL1129905 0.80 FOLH1 (0.51) KCNA5FOLH1KCNH2CYP11B1CYP11B2
SCHEMBL477395 0.80 KCNA5 (0.61) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL28754610 0.80 KCNA5 (0.54) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL11552077 0.79 CYP11B1 (0.69) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL21480390 0.79 PPARA (0.55) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL28754612 0.79 KCNA5 (0.52) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL3288789 0.79 DPP4 (0.62) KCNA5KCNH2CYP11B1CYP11B2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190077894-A1 PROCESS FOR PREPARING CATALYSTS LANXESS DEUTSCHLAND GMBH (DE) 2019-03-14 US disclosed
CN-105289728-B It is used to prepare the method for catalyst 朗盛德国有限责任公司 2018-05-18 CN disclosed
EP-2952256-B1 METHOD FOR THE PRODUCTION OF CATALYSTS LANXESS DEUTSCHLAND GMBH (DE) 2017-05-17 EP disclosed
CN-105289728-A METHOD FOR THE PRODUCTION OF CATALYSTS LANXESS DEUTSCHLAND GMBH 2016-02-03 CN disclosed
US-20150353660-A1 PROCESS FOR PREPARING CATALYSTS LANXESS DEUTSCHLAND GMBH (DE) 2015-12-10 US disclosed
EP-2952256-A1 METHOD FOR THE PRODUCTION OF CATALYSTS LANXESS Deutschland GmbH (DE) 2015-12-09 EP disclosed
US-8932976-B2 Preparation of catalyst for bisphenols production DOW GLOBAL TECHNOLOGIES LLC (US) 2015-01-13 US disclosed
EP-2158040-B1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES INC (US) 2011-02-16 EP disclosed
US-20100152028-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES LLC 2010-06-17 US disclosed
CN-101678354-A The Preparation of catalysts that is used for bisphenol production DOW GLOBAL TECHNOLOGIES INC 2010-03-24 CN disclosed
EP-2158040-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION Dow Global Technologies Inc. (US) 2010-03-03 EP disclosed
WO-2008157025-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES INC. (US) 2008-12-24 WO disclosed