SCHEMBL14419478

SCHEMBL14419478

O=C(O)COc1ccc(F)cc1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 12/20 0.57
▸ CYSLTR1 Q9Y271 1/20 0.56
▸ PKM P14618 1/20 0.54
▸ TDP1 Q9NUW8 2/20 0.52
▸ TSHR P16473 1/20 0.51
▸ MAPT P10636 1/20 0.49
▸ POLB P06746 1/20 0.47
▸ CYSLTR2 Q9NS75 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
SCHEMBL14419297 0.92 PTGDR2 (0.57) PTGDR2CYSLTR1PKMTDP1TSHR
SCHEMBL14419480 0.89 POLB (0.47) PTGDR2CYSLTR1PKMMAPTPOLB
SCHEMBL9209426 0.89 TDP1 (0.62) PTGDR2TDP1TSHRMAPTPOLB
SCHEMBL9214962 0.84 PTGDR2 (0.57) PTGDR2TDP1TSHRMAPTPOLB
SCHEMBL11638829 0.84 POLB (0.47) PTGDR2CYSLTR1MAPTPOLB
SCHEMBL14419229 0.84 PTGDR2 (0.57) PTGDR2PKMTDP1TSHRMAPT
SCHEMBL14419477 0.84 MAPT (0.50) PTGDR2CYSLTR1TDP1MAPTPOLB
SCHEMBL14419280 0.83 PTGDR2 (0.56) PTGDR2PKMTDP1TSHRMAPT
SCHEMBL14419301 0.83 PTGDR2 (0.58) PTGDR2TDP1TSHRMAPT
SCHEMBL8398940 0.82 PTGDR2 (0.70) PTGDR2TDP1TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7273863-B1 Benzophenones as inhibitors of reverse transcriptase SMITHKLINE BEECHAM CORPORATION (US) 2007-09-25 — — US disclosed
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