SCHEMBL7990624

SCHEMBL7990624

C=Cc1cccc(OC)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 1/20 0.46
ERN1 O75460 1/20 0.46
TLR1 Q15399 1/20 0.46
TLR6 Q9Y2C9 1/20 0.46
CA12 O43570 2/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
NFE2L2 Q16236 9/20 0.43
TRPA1 O75762 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 2/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL11856226 0.87 TLR2 (0.37) TLR2ERN1TLR1TLR6CA12
SCHEMBL9311231 0.83 ALDH1A1 (0.37) NFE2L2TRPA1ALDH1A1KMT2AMEN1
SCHEMBL14909 0.82 NFE2L2 (0.55) CA12CA1CA2CA4CA7
SCHEMBL29377009 0.82 NFE2L2 (0.55) CA12CA1CA2CA4CA7
SCHEMBL31689795 0.82 NFE2L2 (0.55) TLR2ERN1TLR1TLR6CA12
SCHEMBL31689790 0.82 NFE2L2 (0.55) TLR2ERN1TLR1TLR6CA12
SCHEMBL1702608 0.81 KMT2A (0.36) TLR2ERN1TLR1TLR6CA12
SCHEMBL6427634 0.81 ALDH1A1 (0.46) TRPA1ALDH1A1CYP3A4KMT2AMEN1
SCHEMBL28414484 0.81 TLR2 (0.44) TLR2ERN1TLR1TLR6CA12
SCHEMBL57085 0.81 NFE2L2 (0.58) NFE2L2MAPTHSD17B10KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed
EP-2455375-B1 Diacylhydrazine ligands for modulating the expression of exogenous genes in mammalian systems via an ecdysone receptor complex INTREXON CORP (US) 2014-11-19 EP disclosed
EP-1077943-B1 HETEROCYCLIC INHIBITORS OF P38 VERTEX PHARMA (US) 2008-12-17 EP disclosed
US-6143806-A ADDITION COPOLYMERIZATION OF MACROMOLECULAR MONOMERS FUJI PHOTO FILM CO., LTD. (JP) 2000-11-07 US disclosed
US-6080449-A EXCELLENT IN REDISPERSIBILITY, STORAGE STABILITY AND PRESS LIFE FUJI PHOTO FILM CO., LTD. (JP) 2000-06-27 US 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
US-4085165-A ISOCYANATE PREPOLYMER, VINYL COMPOUND, POLYAMINE OR POLYETHER CURING AGENT BRIDGESTONE TIRE CO., LTD. (JA) 1978-04-18 US disclosed