SCHEMBL17237652

SCHEMBL17237652

CN(C)Cc1ccc(N2CCO[C@H]([C@@H](O)C(=O)Nc3ccc(C(=N)N)cc3)C2=O)cc1

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F9 P00740 12/20 0.79
HDAC1 Q13547 1/20 0.40
F2 P00734 7/20 0.40
F7 P08709 1/20 0.38

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
SCHEMBL1947680 0.91 F9 (0.81) F9F2F7
SCHEMBL1947516 0.91 F9 (0.81) F9F2
Hydrochloric Acid SCHEMBL1950490 0.90 F9 (0.80) F9F2F7
Hydrochloric Acid SCHEMBL1947095 0.90 F9 (0.80) F9F2
SCHEMBL17237649 0.90 F9 (0.74) F9HDAC1F2
SCHEMBL1949010 0.89 F9 (0.81) F9F2F7
SCHEMBL17237632 0.88 F9 (0.74) F9F2F7
SCHEMBL1946988 0.88 F9 (0.86) F9F2F7
SCHEMBL1948280 0.88 F9 (1.00) F9
SCHEMBL1949100 0.88 F9 (1.00) F9

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
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 EP disclosed