SCHEMBL9795174

SCHEMBL9795174

CC(C)(CN)CNC(=O)C1(OC(=O)/C=C/C(=O)OC2(C(=O)NCC(C)(C)CN)CCC(O[N+](=O)[O-])CC2)CCC(O[N+](=O)[O-])CC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FPR3 P25089 1/20 0.31
FPR2 P25090 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
SCHEMBL9795297 0.89
SCHEMBL9795491 0.83
SCHEMBL9795264 0.81 TPSAB1 (0.31)
SCHEMBL9795295 0.78 L3MBTL1 (0.31)
SCHEMBL9795506 0.77 SMN1; SMN2 (0.35)
SCHEMBL9795421 0.74 CYP2D6 (0.35)
SCHEMBL9795205 0.74 CYP2D6 (0.35)
SCHEMBL9795354 0.74 L3MBTL1 (0.35)
SCHEMBL9795333 0.74 L3MBTL1 (0.35)
Fumaric Acid SCHEMBL9795180 0.73 SMN1; SMN2 (0.42) FPR3FPR2

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
US-5037849-A For treatment of heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1991-08-06 US disclosed