SCHEMBL19619447

SCHEMBL19619447

CCC1CCC(C2CCC(c3ccc(C4CCC(C(N)CC)CC4)cc3F)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 10/20 0.33
DPP4 P27487 8/20 0.33
DPP7 Q9UHL4 5/20 0.33
DPP9 Q86TI2 5/20 0.33
DPP8 Q6V1X1 3/20 0.33
GPR119 Q8TDV5 1/20 0.31
DGAT1 O75907 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
SCHEMBL18458721 0.89 SPHK1 (0.35) DPP4DPP7DPP9DPP8
SCHEMBL18458716 0.89 SPHK1 (0.35) DPP4DPP7DPP9DPP8
SCHEMBL12918358 0.87 OPRL1 (0.35) OPRL1GPR119
SCHEMBL19619457 0.86 DPP4 (0.32) OPRL1DPP4DPP7DPP9DPP8
SCHEMBL19711822 0.86 DPP4 (0.32) OPRL1DPP4DPP7DPP9DPP8
SCHEMBL10043334 0.85 OPRL1 (0.37) OPRL1DGAT1
SCHEMBL10043145 0.85 OPRL1 (0.37) OPRL1DGAT1
SCHEMBL18458837 0.84 DPP4 (0.40) DPP4DPP7DPP9DPP8
SCHEMBL20160836 0.84 DPP4 (0.40) DPP4DPP7DPP9DPP8
SCHEMBL10043154 0.84 OPRL1 (0.39) OPRL1

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-9822304-B2 Liquid crystal composition and liquid crystal display element containing the same DIC CORPORATION (JP) 2017-11-21 US disclosed