SCHEMBL7542298

SCHEMBL7542298

C=Cc1cccc(F)c1C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 9/20 0.41
ALDH1A1 P00352 2/20 0.38
ERN1 O75460 1/20 0.38
ACHE P22303 1/20 0.37
TP53 P04637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TAAR1 Q96RJ0 2/20 0.34
CYP2D6 P10635 1/20 0.34
ESR2 Q92731 2/20 0.33
GAA P10253 1/20 0.33
ESR1 P03372 1/20 0.32

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
SCHEMBL6427634 0.83 ALDH1A1 (0.46) ALDH1A1ACHETP53TDP1ESR2
SCHEMBL7086146 0.82 NFE2L2 (0.39) NFE2L2ALDH1A1ERN1ACHETDP1
SCHEMBL23707435 0.79 NFE2L2 (0.40) NFE2L2ERN1ACHETAAR1CYP2D6
SCHEMBL97029 0.77 ERN1 (0.57) NFE2L2ALDH1A1ERN1ACHETDP1
SCHEMBL29956284 0.77 ERN1 (0.57) NFE2L2ALDH1A1ERN1ACHETDP1
SCHEMBL16951325 0.77 ERN1 (0.42) NFE2L2ALDH1A1ERN1ACHETAAR1
SCHEMBL466535 0.76 NFE2L2 (0.44) NFE2L2ALDH1A1ERN1ACHE
SCHEMBL20540071 0.76 ALDH1A1 (0.41) ALDH1A1TP53TDP1ESR2
SCHEMBL28496 0.76 TRPA1 (0.42) NFE2L2ALDH1A1ACHETP53TDP1
SCHEMBL17220278 0.76 TRPA1 (0.42) NFE2L2ALDH1A1ACHETP53TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6080819-A Blends of olefin polymers and syndiotactic vinyl polymers BOREALIS AG (AT) 2000-06-27 US claimed
WO-2023070076-A1 COMPOUNDS FOR CANCERS DRIVEN BY BRAF MUTATION THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2023-04-27 WO disclosed
EP-4112606-A1 AROMATIC COMPOUND AND USE THEREOF IN PREPARING ANTINEOPLASTIC DRUGS Shanghai Zheye Biotechnology Co., Ltd. (CN) 2023-01-04 EP disclosed
CN-107614555-A Method for producing thermoplastic elastomer and thermoplastic elastomer 株式会社钟化 2018-01-19 CN disclosed
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed
WO-2011032277-A1 QUINAZOLINONE DERIVATIVES AS VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-03-24 WO disclosed
CN-1367721-A Process for hydrophobic treatment of water vapour permeable substrates PROCTER & GAMBLE (US) 2002-09-04 CN disclosed
EP-1211284-A1 Semi-finished products or moulded materials of improved toughness made from propylene polymers Borealis GmbH (AT) 2002-06-05 EP disclosed
US-6080819-A Blends of olefin polymers and syndiotactic vinyl polymers BOREALIS AG (AT) 2000-06-27 US disclosed
EP-0884356-A2 Blends of polyolefins and syndiotactic vinyl polymeres PCD Polymere AG (AT) 1998-12-16 EP disclosed
US-5326489-A Sulfonated polymer NIPPON SHOKUBAI CO., LTD. (JP) 1994-07-05 US disclosed
EP-0523300-B1 Electrorheological fluids NIPPON CATALYTIC CHEM IND (JP) 1994-01-19 EP disclosed
EP-0523300-A1 Electrorheological fluids NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) 1993-01-20 EP disclosed