SCHEMBL746609

SCHEMBL746609

C#CCN1CC(=O)N2[C@@H](C(C)CC)C(=O)N(CCc3ccc(C(F)(F)F)cc3)C[C@@H]2N1C(=O)NCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CLPP Q16740 19/20 0.53
CYP3A4 P08684 1/20 0.39

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
SCHEMBL748291 0.94 CLPP (0.50) CLPP
SCHEMBL762834 0.92 CLPP (0.47) CLPP
SCHEMBL748075 0.90 CLPP (0.52) CLPPCYP3A4
SCHEMBL747982 0.89 CLPP (0.49) CLPP
SCHEMBL745347 0.89 CLPP (0.48) CLPP
SCHEMBL745119 0.88 CLPP (0.50) CLPP
SCHEMBL10224907 0.88 CLPP (0.53) CLPP
SCHEMBL13708923 0.88 CLPP (0.45) CLPP
SCHEMBL747998 0.88 CLPP (0.53) CLPP
SCHEMBL745192 0.87 CLPP (0.49) CLPP

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-8138337-B2 Reverse-turn mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2012-03-20 US disclosed