SCHEMBL9214962

SCHEMBL9214962

Cc1ccc(OCC(=O)O)c(C(=O)c2ccc(Cl)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 8/20 0.57
▸ TDP1 Q9NUW8 2/20 0.55
▸ TSHR P16473 1/20 0.55
▸ POLB P06746 1/20 0.53
▸ TP53 P04637 1/20 0.50
▸ MAPT P10636 3/20 0.49
▸ THRB P10828 1/20 0.49
▸ CYSLTR2 Q9NS75 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47

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
SCHEMBL9214221 0.92 TDP1 (0.58) PTGDR2TDP1TSHRPOLBTP53
SCHEMBL9213387 0.89 TDP1 (0.55) PTGDR2TDP1TSHRPOLBTP53
SCHEMBL9209426 0.89 TDP1 (0.62) PTGDR2TDP1TSHRPOLBTP53
SCHEMBL9217624 0.86 PTGDR2 (0.69) PTGDR2MAPT
SCHEMBL9212883 0.86 PTGDR2 (0.57) PTGDR2TP53MAPTKDM4E
SCHEMBL9218825 0.84 TDP1 (0.52) PTGDR2TDP1TSHRPOLBMAPT
SCHEMBL21467267 0.84 POLB (0.57) POLBTP53MAPTTHRBKDM4E
SCHEMBL14419478 0.84 PTGDR2 (0.57) PTGDR2TDP1TSHRPOLBMAPT
SCHEMBL30070794 0.84 POLB (0.57) POLBTP53MAPTTHRBKDM4E
SCHEMBL14419292 0.83 PTGDR2 (0.56) PTGDR2TDP1TSHRPOLBTP53

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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