SCHEMBL9218825

SCHEMBL9218825

CCc1ccc(OCC(=O)O)c(C(=O)c2ccc(Cl)cc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.52
▸ TSHR P16473 1/20 0.52
▸ PTGDR2 Q9Y5Y4 9/20 0.52
▸ POLB P06746 1/20 0.48
▸ PPARD Q03181 2/20 0.47
▸ PPARG P37231 1/20 0.47
▸ PPARA Q07869 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ CYSLTR2 Q9NS75 1/20 0.45
▸ MRGPRX4 Q96LA9 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ PTGDR Q13258 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL9209426 0.86 TDP1 (0.62) TDP1TSHRPTGDR2POLBMAPT
SCHEMBL9214962 0.84 PTGDR2 (0.57) TDP1TSHRPTGDR2POLBMAPT
SCHEMBL11525710 0.83 CFD (0.55) TSHRPOLBPPARDPPARGPPARA
SCHEMBL11527338 0.82 ALDH1A1 (0.52) POLBPPARDPPARGPPARAMAPT
SCHEMBL9214221 0.82 TDP1 (0.58) TDP1TSHRPTGDR2POLBMAPT
SCHEMBL14419478 0.82 PTGDR2 (0.57) TDP1TSHRPTGDR2POLBMAPT
SCHEMBL8398940 0.80 PTGDR2 (0.70) TDP1TSHRPTGDR2MAPTPTGDR
SCHEMBL15331250 0.79 PTGDR2 (0.66) TDP1TSHRPTGDR2POLBPPARD
SCHEMBL14419539 0.79 PTGDR2 (0.69) TDP1TSHRPTGDR2PPARDMAPT
SCHEMBL14419297 0.79 PTGDR2 (0.57) TDP1TSHRPTGDR2MAPTPTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0512570-B1 Urea derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1995-10-11 — — EP disclosed
EP-0512570-A1 Urea derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-11-11 — — EP disclosed
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