SCHEMBL19861659

SCHEMBL19861659

CNCCC(C)C(C)N(C(C)=O)C1CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 1/20 0.33
PIK3CD O00329 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
SCHEMBL19861665 0.83 KISS1R (0.30) KISS1R
SCHEMBL19861661 0.77 KISS1R (0.42) KISS1RPIK3CD
SCHEMBL2736131 0.77 PIK3CD (0.31) PIK3CD
SCHEMBL19861600 0.74 KISS1R (0.37) KISS1R
SCHEMBL7164955 0.69 PIK3CD (0.35) PIK3CD
SCHEMBL7164958 0.69 PIK3CD (0.35) PIK3CD
SCHEMBL2736124 0.69 ALDH1A1 (0.33) PIK3CD
SCHEMBL17190669 0.68 PIK3CD (0.37) PIK3CD
SCHEMBL2736134 0.68
SCHEMBL2760066 0.68 ALDH1A1 (0.32) PIK3CD

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-9891239-B2 Modulators of pharmacokinetic properties of therapeutics GILEAD SCIENCES, INC. (US) 2018-02-13 US disclosed