SCHEMBL6743198

SCHEMBL6743198

Cc1cc(Br)c(O)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.40
ALOX12 P18054 3/20 0.37
CYP3A4 P08684 2/20 0.36
HPGD P15428 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
G6PD P11413 1/20 0.36
CYP2C9 P11712 1/20 0.36
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
CCR6 P51684 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 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
SCHEMBL10907457 0.89 ALOX15 (0.42) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL68996 0.86 ALOX15 (0.43) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL5698265 0.86 ALOX15 (0.43) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL282020 0.83 ALOX15 (0.55) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL29446755 0.83 ALOX15 (0.55) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL1146850 0.83 ALOX15 (0.55) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL30283411 0.83 ALOX15 (0.48) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL482183 0.83 ALOX15 (0.48) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL12572587 0.83 ALOX15 (0.48) ALOX15ALOX12CYP3A4HPGDNPSR1
SCHEMBL120851 0.82 ALDH1A1 (0.42) CYP3A4HPGDALDH1A1MAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160137842-A1 ARTICLE OF MANUFACTURE CONTAINING A FLAME RETARDANT FILLER PREPARED FROM A BRIDGED POLYSILSESQUIOXANE INTERNATIONAL BUSINESS MACHINES CORPORATION 2016-05-19 US disclosed
US-8962779-B2 Method of forming polyaryl polymers DOW GLOBAL TECHNOLOGIES LLC (US) 2015-02-24 US disclosed
EP-2311893-B1 COMPOUND CONTAINING 1,3-DIENE STRUCTURE AND METHOD FOR PRODUCING SAME SUMITOMO CHEMICAL CO (JP) 2014-09-24 EP disclosed
US-20040254305-A1 Epoxy resin composition for photosemiconductor package CHANG CHUN PLASTIC CO., LTD. (TW) 2004-12-16 US disclosed
EP-0739879-B1 Halogen-containing cyanate ester, process for producing the same and thermosetting resin composition containing the same SUMITOMO CHEMICAL CO (JP) 1999-12-22 EP disclosed
EP-0739879-A1 Halogen-containing cyanate ester, process for producing the same and thermosetting resin composition containing the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-30 EP disclosed
US-4010252-A POLYQUATERNARY AMMONIUM COMPOUND, DEODORANTS COLGATE-PALMOLIVE COMPANY (US) 1977-03-01 US disclosed