SCHEMBL7340918

SCHEMBL7340918

CCOC(=O)/C=C/CCc1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 2/20 0.44
LMNA P02545 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 1/20 0.43
TTR P02766 1/20 0.42
DPP4 P27487 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
GPR52 Q9Y2T5 6/20 0.42
RAB9A P51151 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL16831439 0.88 GPR52 (0.54) MAPTALDH1A1TTRDPP4CA12
SCHEMBL16831438 0.88 GPR52 (0.54) MAPTALDH1A1TTRDPP4CA12
SCHEMBL19321725 0.85 GPR52 (0.55) MAPTMEN1KMT2ACYP1A2LMNA
SCHEMBL1268421 0.84 MAPT (0.62) MAPTGPR52
SCHEMBL28570960 0.84 GPR52 (0.47) KMT2AGPR52
SCHEMBL1268422 0.84 MAPT (0.62) MAPTGPR52
SCHEMBL1269249 0.84 GPR52 (0.57) MAPTKMT2AALDH1A1GPR52
SCHEMBL1269252 0.84 GPR52 (0.57) MAPTKMT2AALDH1A1GPR52
SCHEMBL27311625 0.82 MAPT (0.59) MAPTGPR52
SCHEMBL27310628 0.82 MAPT (0.59) MAPTGPR52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0866705-A4 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 1999-03-03 EP disclosed
US-5852045-A Fibrinogen receptor antagonists MERCK & CO., INC. (US) 1998-12-22 US disclosed
EP-0866705-A1 FIBRINOGEN RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 1998-09-30 EP disclosed
WO-1997014417-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1997-04-24 WO disclosed