SCHEMBL842664

SCHEMBL842664

SCCCCc1ccncc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.59
LOXL2 Q9Y4K0 2/20 0.50
NAAA Q02083 1/20 0.48
HRH3 Q9Y5N1 3/20 0.46
HRH4 Q9H3N8 2/20 0.46
CYP1A2 P05177 4/20 0.41
CYP3A4 P08684 4/20 0.41
CYP2D6 P10635 3/20 0.41
CYP2C9 P11712 3/20 0.41
CYP2C19 P33261 3/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HIF1A Q16665 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPC1 O15118 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL272061 0.98 HRH1 (0.63) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL842668 0.93 HRH1 (0.56) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL726645 0.87 HRH1 (0.73) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL725306 0.85 HRH1 (0.77) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL4413800 0.85 HRH1 (0.77) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL2841394 0.85 HRH1 (0.77) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL73482 0.82
SCHEMBL351920 0.82 HRH1 (0.65) HRH1LOXL2NAAAHRH3HRH4
Hydrochloric Acid SCHEMBL258153 0.80 LOXL2 (0.54) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL31673871 0.79 HRH1 (0.62) HRH1LOXL2NAAAHRH3HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6946581-B2 Bisphenol compound composition having excellent thermal stability MITSUBISHI CHEMICAL CORPORATION (JP) 2005-09-20 US claimed
EP-2948771-B1 CHEMICAL SENSING DEVICE HEWLETT PACKARD DEVELOPMENT CO (US) 2019-04-10 EP disclosed
US-20190077894-A1 PROCESS FOR PREPARING CATALYSTS LANXESS DEUTSCHLAND GMBH (DE) 2019-03-14 US disclosed
EP-2952256-B1 METHOD FOR THE PRODUCTION OF CATALYSTS LANXESS DEUTSCHLAND GMBH (DE) 2017-05-17 EP disclosed
US-20150362433-A1 CHEMICAL SENSING DEVICE HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2015-12-17 US 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
EP-2948771-A1 CHEMICAL SENSING DEVICE Hewlett-Packard Development Company L.P. (US) 2015-12-02 EP disclosed
US-8932976-B2 Preparation of catalyst for bisphenols production DOW GLOBAL TECHNOLOGIES LLC (US) 2015-01-13 US disclosed
WO-2014116234-A1 CHEMICAL SENSING DEVICE HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2014-07-31 WO disclosed
US-20100152028-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES LLC 2010-06-17 US disclosed
EP-2158040-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION Dow Global Technologies Inc. (US) 2010-03-03 EP disclosed
WO-2009032552-A2 METHOD OF REDUCING METHANOL IN RECYCLE STREAMS IN BISPHENOL-A-PRODUCTION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2009-03-12 WO disclosed
WO-2008157025-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES INC. (US) 2008-12-24 WO disclosed
US-6946581-B2 Bisphenol compound composition having excellent thermal stability MITSUBISHI CHEMICAL CORPORATION (JP) 2005-09-20 US disclosed
US-20030234381-A1 Bisphenol compound composition having excellent thermal stability MITSUBISHI CHEMICAL CORPORATION (JP) 2003-12-25 US disclosed
US-4478956-A FOR CATALYTIC CONDENSATION OF PHENOL WITH KETONE MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1984-10-23 US disclosed
EP-0045959-B1 PROCESS FOR PREPARING BISPHENOLS MITSUBISHI KASEI CORPORATION (JP) 1984-04-04 EP disclosed
US-4423252-A CONDENSATION OF A PHENOL WITH A KETONE IN THE PRESENCE OF A SULFONIC ACID TYDE CATION EXCHANGE RESIN MODIFIED WITH A PYRIDINE-ALKANE THIOL MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1983-12-27 US disclosed
EP-0045959-A1 Process for preparing bisphenols MITSUBISHI KASEI CORPORATION (JP) 1982-02-17 EP disclosed