SCHEMBL9217624

SCHEMBL9217624

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

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 15/20 0.69
▸ NPC1 O15118 1/20 0.56
▸ MAPT P10636 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ PPARD Q03181 1/20 0.50

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
SCHEMBL9212883 0.86 PTGDR2 (0.57) PTGDR2MAPT
SCHEMBL9214962 0.86 PTGDR2 (0.57) PTGDR2MAPT
SCHEMBL14419539 0.84 PTGDR2 (0.69) PTGDR2MAPTPPARD
SCHEMBL14066214 0.82 PTGDR2 (0.60) PTGDR2
SCHEMBL21987043 0.82 PTGDR2 (0.80) PTGDR2
SCHEMBL21987061 0.82 PTGDR2 (1.00) PTGDR2MAPTMAPK1
SCHEMBL9214221 0.81 TDP1 (0.58) PTGDR2MAPT
SCHEMBL21987094 0.79 PTGDR2 (0.74) PTGDR2NPC1MAPT
SCHEMBL29951797 0.78 PTGDR2 (0.69) PTGDR2MAPTHTT
SCHEMBL7067039 0.77 PTGDR2 (0.50) PTGDR2PPARD

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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