SCHEMBL14583978

SCHEMBL14583978

N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccc(F)c(F)c1)NC(=O)Nc1ccc2c(CN3CCCC3)cn(Cc3c(Cl)cccc3Cl)c2c1)C(=O)NCc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F2R P25116 20/20 0.77
▸ F2 P00734 2/20 0.77

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
SCHEMBL4263176 0.92 F2R (0.85) F2RF2
SCHEMBL13945253 0.83 F2R (0.74) F2RF2
SCHEMBL14583987 0.82 F2R (0.55) F2RF2
SCHEMBL14614029 0.81 F2R (0.52) F2RF2
Rwj-58259 SCHEMBL14090275 0.80 F2R (0.83) F2RF2
SCHEMBL12340158 0.80 F2R (0.65) F2RF2
SCHEMBL12340155 0.79 F2R (0.67) F2RF2
SCHEMBL14583974 0.79 F2R (0.53) F2RF2
SCHEMBL14583983 0.78 F2R (0.82) F2RF2
SCHEMBL13945255 0.78 F2R (0.62) F2RF2

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-7183252-B2 Indole peptidomimetics as thrombin receptor antagonists ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2007-02-27 — — US disclosed
Send feedback