SCHEMBL8923052

SCHEMBL8923052

C=C(C)C(=O)OCC(CCO)OC(=O)c1ccccc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.46
TSHR P16473 5/20 0.38
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
TP53 P04637 2/20 0.36
HSD17B10 Q99714 1/20 0.36
PTGS2 P35354 1/20 0.36
CYP3A4 P08684 2/20 0.35
CA2 P00918 1/20 0.35
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL9615565 0.91 ALDH1A1 (0.45) ALDH1A1TSHRPRSS1PRSS2PRSS3
SCHEMBL8608286 0.90 ALDH1A1 (0.44) ALDH1A1TSHRPRSS1PRSS2PRSS3
SCHEMBL10339546 0.90 ALDH1A1 (0.43) ALDH1A1TSHRPRSS1PRSS2PRSS3
SCHEMBL12789621 0.89 TSHR (0.42) ALDH1A1TSHRTP53HSD17B10PTGS2
SCHEMBL9615555 0.88 ALDH1A1 (0.45) ALDH1A1TSHRPRSS1PRSS2PRSS3
SCHEMBL9615545 0.84 POLB (0.41) ALDH1A1TSHRPTGS2CYP3A4POLB
SCHEMBL3268987 0.84 ALDH1A1 (0.43) ALDH1A1TSHRTP53HSD17B10PTGS2
SCHEMBL8607952 0.83 ALDH1A1 (0.43) ALDH1A1TSHRPRSS1PRSS2PRSS3
SCHEMBL12791621 0.83 ALDH1A1 (0.39) ALDH1A1TSHRPRSS1PRSS2PRSS3
SCHEMBL751505 0.83 ALDH1A1 (0.43) ALDH1A1TSHRTP53HSD17B10PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4481280-A Photosensitive polyamide resin composition TORAY INDUSTRIES, INC. (JP) 1984-11-06 US claimed
US-5698373-A Photosensitive relief printing plate and photosensitive intaglio printing plate TORAY INDUSTRIES, INCORPORATED (JP) 1997-12-16 US disclosed
EP-0360255-B1 Photosensitive relief printing plate and photosensitive intaglio printing plate TORAY INDUSTRIES (JP) 1995-02-22 EP disclosed
EP-0181094-B1 ADHESIVE FOR CHLORINE-CONTAINING POLYMERS AND AROMATIC GROUP-CONTAINING POLYMERS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-12-13 EP disclosed
US-4880873-A HEAT RESISTANT MODIFIED ETHYLENE VINYL ALCOHOL COPOLYMERS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-11-14 US disclosed
EP-0181094-A1 Adhesive for chlorine-containing polymers and aromatic group-containing polymers MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1986-05-14 EP disclosed
US-4481280-A Photosensitive polyamide resin composition TORAY INDUSTRIES, INC. (JP) 1984-11-06 US disclosed
EP-0036301-A1 Photosensitive polyamide resin composition TORAY INDUSTRIES, INC. (JP) 1981-09-23 EP disclosed