SCHEMBL9213387

SCHEMBL9213387

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

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.55
▸ TSHR P16473 1/20 0.55
▸ POLB P06746 1/20 0.50
▸ TP53 P04637 3/20 0.49
▸ RECQL P46063 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ PTGDR2 Q9Y5Y4 4/20 0.47
▸ THRB P10828 1/20 0.46
▸ MAPT P10636 4/20 0.46
▸ PPARD Q03181 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ AKR1B10 O60218 1/20 0.44
▸ AKR1B1 P15121 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ CYSLTR2 Q9NS75 1/20 0.44

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
SCHEMBL9214962 0.89 PTGDR2 (0.57) TDP1TSHRPOLBTP53PTGDR2
SCHEMBL9214221 0.84 TDP1 (0.58) TDP1TSHRPOLBTP53RECQL
SCHEMBL9209426 0.80 TDP1 (0.62) TDP1TSHRPOLBTP53PTGDR2
SCHEMBL11539857 0.80 CYP2C9 (0.57) TDP1TSHRTP53RECQLSMN1; SMN2
SCHEMBL14273070 0.79 PTGDR2 (0.56) TDP1TSHRPOLBSMN1; SMN2PTGDR2
SCHEMBL11540896 0.79 CYP2C9 (0.60) TDP1TSHRPOLBTP53RECQL
SCHEMBL18791370 0.78 PTGDR2 (0.56) TDP1TSHRPOLBSMN1; SMN2PTGDR2
SCHEMBL9212096 0.77 MAPT (0.46) TDP1TSHRPOLBTP53RECQL
SCHEMBL9218825 0.76 TDP1 (0.52) TDP1TSHRPOLBPTGDR2MAPT
SCHEMBL1324243 0.76 TDP1 (0.70) TDP1TSHRPTGDR2MAPTPPARD

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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