SCHEMBL8315856

SCHEMBL8315856

O=C(NCc1ccc(N2CC(CCl)OC2=O)cc1)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 6/20 0.48
F10 P00742 3/20 0.46
PLAU P00749 1/20 0.46
TNKS O95271 2/20 0.45
TNKS2 Q9H2K2 2/20 0.45
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
TPSAB1 Q15661 1/20 0.43
TPSD1 Q9BZJ3 1/20 0.43
TPSG1 Q9NRR2 1/20 0.43

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
SCHEMBL8948650 0.76 SIGMAR1 (0.41) GRM2F10
SCHEMBL15221195 0.76 F10 (0.65) F10
SCHEMBL7298956 0.76 GRM2 (0.69) GRM2F10
SCHEMBL8948654 0.75 RECQL (0.36) GRM2F10TNKSTNKS2
SCHEMBL592344 0.73 CHRM2 (0.46) GRM2F10
SCHEMBL592809 0.73 POLB (0.43) GRM2F10
Benzyl Benzylcarbamate SCHEMBL1136818 0.73 PLAU (0.70) PLAUTNKSTNKS2HDAC3HDAC1
SCHEMBL28584298 0.72 PLAU (0.54) PLAUTNKSTNKS2HDAC3HDAC1
SCHEMBL7314568 0.72 F10 (0.48) GRM2F10
Benzyl Benzylcarbamate SCHEMBL19810513 0.71 PLAU (0.68) PLAUTNKSTNKS2HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623615-B1 Substituted 1-phenyl-oxazolidin-2-one derivatives, their preparation and their use as adhesion-receptor antagonists MERCK PATENT GMBH (DE) 1999-06-30 EP disclosed
US-5532255-A Adhesion receptor antagonists MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-07-02 US disclosed
EP-0623615-A1 Adhesion-receptor antagonists MERCK PATENT GmbH (DE) 1994-11-09 EP disclosed