SCHEMBL20169777

SCHEMBL20169777

CCCCCCCCCCCNC(=O)C(C)CCCNC(=N)N

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPP7 Q9UHL4 2/20 0.51
▸ RRM1 P23921 1/20 0.51
▸ GNAI3 P08754 1/20 0.49
▸ GNAO1 P09471 1/20 0.49
▸ GNAI1 P63096 1/20 0.49
▸ MMP8 P22894 1/20 0.46
▸ EPHX1 P07099 6/20 0.45
▸ SIRT6 Q8N6T7 1/20 0.45
▸ SIRT1 Q96EB6 1/20 0.45
▸ SPHK1 Q9NYA1 3/20 0.44
▸ CNR1 P21554 1/20 0.44
▸ S1PR2 O95136 1/20 0.43
▸ S1PR1 P21453 1/20 0.43
▸ S1PR3 Q99500 1/20 0.43
▸ S1PR5 Q9H228 1/20 0.43

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
SCHEMBL20072685 0.97 GNAI3 (0.52) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL20072809 0.95 DPP7 (0.53) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL21782662 0.86 DPP7 (0.41) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL28052266 0.85 GNAI3 (0.58) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL28052076 0.85 GNAI3 (0.58) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL28100557 0.85 GNAI3 (0.58) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL14874696 0.85 GNAI3 (0.58) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL28285001 0.85 GNAI3 (0.58) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL28328772 0.85 DPP7 (0.62) DPP7RRM1GNAI3GNAO1GNAI1
SCHEMBL24420660 0.85 DPP7 (0.73) DPP7RRM1GNAI3GNAO1GNAI1

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-9975847-B2 Amino acid derivatives and their uses JOHNSON & JOHNSON CONSUMER INC. (US) 2018-05-22 — — US disclosed
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