SCHEMBL5627237

SCHEMBL5627237

O=C(Cl)COc1ccc(Cl)cc1C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.57
TP53 P04637 4/20 0.56
MAPT P10636 2/20 0.54
GAA P10253 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 1/20 0.54
ALDH1A1 P00352 2/20 0.48
THRB P10828 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MITF O75030 1/20 0.47
HSP90AA1 P07900 1/20 0.47
HTT P42858 1/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TLR9 Q9NR96 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
SCHEMBL8398940 0.90 PTGDR2 (0.70) PTGDR2TP53MAPTGAASMN1; SMN2
SCHEMBL12798165 0.87 MAPT (0.56) PTGDR2TP53MAPTGAASMN1; SMN2
SCHEMBL14419546 0.85 PTGDR2 (0.54) PTGDR2TP53MAPTGAASMN1; SMN2
SCHEMBL27533944 0.85 SMN1; SMN2 (0.60) PTGDR2TP53MAPTGAASMN1; SMN2
SCHEMBL11036014 0.85 MAPT (0.63) PTGDR2TP53MAPTGAASMN1; SMN2
SCHEMBL11642707 0.83 PTGDR2 (0.50) PTGDR2TP53MAPTGAASMN1; SMN2
SCHEMBL27336880 0.83 PTGER1 (0.62) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL21067312 0.83 TP53 (0.66) TP53MAPTGAASMN1; SMN2LMNA
SCHEMBL14419325 0.83 HPGD (0.58) PTGDR2TP53MAPTGAASMN1; SMN2
SCHEMBL14419541 0.82 PTGDR2 (0.56) PTGDR2TP53CYP2C9

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 5 patents. 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
US-7273863-B1 Benzophenones as inhibitors of reverse transcriptase SMITHKLINE BEECHAM CORPORATION (US) 2007-09-25 US disclosed
EP-1710238-A1 Benzophenones as inhibitors of reverse transcriptase GLAXO GROUP LIMITED (GB) 2006-10-11 EP disclosed
EP-1208091-A1 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE GLAXO GROUP LIMITED (GB) 2002-05-29 EP disclosed
WO-2001017982-A1 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE GLAXO GROUP LIMITED (GB) 2001-03-15 WO disclosed