SCHEMBL4138140

SCHEMBL4138140

COc1c(C(=O)O)ccc2cc(O)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.49
ESR2 Q92731 1/20 0.49
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALDH1A1 P00352 4/20 0.46
CA12 O43570 3/20 0.46
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA7 P43166 3/20 0.46
CA9 Q16790 3/20 0.46
CA14 Q9ULX7 3/20 0.46
TSHR P16473 1/20 0.46
CYP1A1 P04798 1/20 0.43
CYP1B1 Q16678 1/20 0.43
HSD17B10 Q99714 2/20 0.42
HPGD P15428 4/20 0.42
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALOX5 P09917 1/20 0.42

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
SCHEMBL4943600 0.81 CA12 (0.57) ESR1ESR2ALDH1A1CA12CA1
SCHEMBL9679999 0.80 TDP1 (0.55) MAPTTDP1ALDH1A1CA12CA1
SCHEMBL1671110 0.78 CYP1A1 (0.64) MAPTTDP1ALDH1A1TSHRCYP1A1
SCHEMBL4137339 0.78 CA12 (0.50) ESR1ESR2MAPTTDP1ALDH1A1
SCHEMBL9623607 0.78 ESR1 (0.75) ESR1ESR2MAPTTDP1ALDH1A1
SCHEMBL3391531 0.78 LDHA (0.61) TDP1ALDH1A1CA12CA1CA2
SCHEMBL9939663 0.77 ESR2 (0.49) ESR1ESR2CA12CA1CA2
SCHEMBL2187409 0.76 CA12 (0.52) TDP1ALDH1A1CA12CA1CA2
SCHEMBL24116321 0.76 CA12 (0.38) ESR1ESR2MAPTTDP1ALDH1A1
SCHEMBL14880025 0.75 ALDH1A1 (0.47) ESR2MAPTTDP1ALDH1A1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1983020-B1 METHOD FOR MODIFICATION OF LIQUID CRYSTAL POLYMER LEF TECHNOLOGY INC (JP) 2014-05-07 EP disclosed
US-7608371-B2 Irradiating polyesters with laser beam having pulse width of 10-12 seconds or less to improve physical strength; abrasion resistance LEF TECHNOLOGY, INC. (JP) 2009-10-27 US disclosed
US-20090048362-A1 Method of Modifying Liquid Crystal Polymers LEF TECHNOLOGY, INC. (JP) 2009-02-19 US disclosed
EP-1983020-A1 METHOD FOR MODIFICATION OF LIQUID CRYSTAL POLYMER LEF Technology Inc. (JP) 2008-10-22 EP disclosed