SCHEMBL18896367

SCHEMBL18896367

CCCCc1cc(C)cc(Br)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.44
PTGS2 P35354 4/20 0.42
TYR P14679 3/20 0.42
HTT P42858 3/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ESR1 P03372 1/20 0.39
MAOA P21397 1/20 0.37
EGFR P00533 1/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL280118 0.86 TYR (0.48) ALOX5PTGS2TYRHTTMAPT
SCHEMBL28665182 0.84 TYR (0.47) ALOX5PTGS2TYRHTTMAPT
SCHEMBL29112780 0.84 TYR (0.47) ALOX5PTGS2TYRHTTMAPT
SCHEMBL29038541 0.83 GFER (0.50) ALOX5PTGS2TYRHTTMAPT
SCHEMBL11603043 0.83 TYR (0.43) ALOX5PTGS2TYRHTTMAPT
SCHEMBL1023112 0.82 TYR (0.46) ALOX5PTGS2TYRHTTMAPT
SCHEMBL28181639 0.82 TYR (0.46) ALOX5PTGS2TYRHTTMAPT
SCHEMBL1141588 0.81 AMY1A (0.53) ALOX5PTGS2TYRHTTMAPT
SCHEMBL1023755 0.81 HTT (0.46) ALOX5PTGS2TYRHTTMAPT
SCHEMBL11157515 0.81 AMY1A (0.53) ALOX5PTGS2TYRHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11833495-B2 Heterobimetallic catalysts and site-differentiated ligands for preparation thereof UNIVERSITY OF HOUSTON SYSTEM (US) 2023-12-05 US disclosed
US-20230249169-A1 HETEROBIMETALLIC CATALYSTS AND SITE-DIFFERENTIATED LIGANDS FOR PREPARATION THEREOF UNIVERSITY OF HOUSTON SYSTEM (US) 2023-08-10 US disclosed
US-11712686-B2 Heterobimetallic catalysts and site-differentiated ligands for preparation thereof UNIVERSITY OF HOUSTON SYSTEM (US) 2023-08-01 US disclosed
US-11358134-B2 Heterobimetallic catalysts and site-differentiated ligands for preparation thereof UNIVERSITY OF HOUSTON SYSTEM (US) 2022-06-14 US disclosed
EP-3143006-B1 SYNTHESIS OF ARYL COUPLED BIS PHENOXIDES AND THEIR USE IN OLEFIN POLYMERIZATION CATALYST SYSTEMS WITH ACTIVATOR-SUPPORTS CHEVRON PHILLIPS CHEMICAL CO LP (US) 2018-07-25 EP disclosed
US-9663594-B2 Synthesis of aryl coupled bis phenoxides and their use in olefin polymerization catalyst systems with activator-supports CHEVRON PHILIPS CHEMICAL COMPANY LP (US) 2017-05-30 US disclosed