SCHEMBL18896151

SCHEMBL18896151

CCCCCNC(=O)C(CCCC)CCCC

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.67
USP2 O75604 2/20 0.58
RRM1 P23921 1/20 0.56
EPHX1 P07099 6/20 0.54
GNAI3 P08754 1/20 0.53
GNAO1 P09471 1/20 0.53
GNAI1 P63096 1/20 0.53
FNTA P49354 1/20 0.53
FNTB P49356 1/20 0.53
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
TSHR P16473 1/20 0.50
S1PR2 O95136 2/20 0.49
S1PR1 P21453 2/20 0.49
S1PR3 Q99500 2/20 0.49
S1PR5 Q9H228 1/20 0.49
MMP8 P22894 1/20 0.49
CASP2 P42575 1/20 0.48

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
SCHEMBL20152116 0.96 DPP7 (0.61) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL30542445 0.94 GNAI3 (0.60) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL22643752 0.94 GNAI3 (0.60) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL14515546 0.94 GNAI3 (0.60) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL2482508 0.94 GNAI3 (0.60) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL22414705 0.92 USP2 (0.69) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL24072868 0.92 DPP7 (0.61) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL26133522 0.90 GNAI3 (0.57) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL22857535 0.90 GNAI3 (0.56) DPP7USP2RRM1EPHX1GNAI3
SCHEMBL24932113 0.90 GNAI3 (0.56) DPP7USP2RRM1EPHX1GNAI3

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-9663466-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-05-30 US disclosed