SCHEMBL9112013

SCHEMBL9112013

O=C(CCCCO)C1COCCN1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31

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
SCHEMBL7466115 0.85 PRCP (0.40) GPR84FFAR1FFAR4
SCHEMBL294072 0.85 CTSC (0.32) CTSC
SCHEMBL293662 0.84 CTSC (0.31) CTSC
SCHEMBL293579 0.83 CTSC (0.32) CTSC
SCHEMBL293636 0.79 CTSC (0.33) CTSC
SCHEMBL4685866 0.79 HSD17B10 (0.33) CTSC
SCHEMBL294561 0.77 CTSC (0.35) CTSC
SCHEMBL295040 0.75 CTSC (0.34) CTSC
SCHEMBL17265953 0.75 CTSC (0.34) CTSC
SCHEMBL6243593 0.74 CTSC (0.36) CTSC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed