SCHEMBL20072685

SCHEMBL20072685

CCCCCC(C)C(=O)NCCCCCCNC(=N)N

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GNAI3 P08754 1/20 0.52
▸ GNAO1 P09471 1/20 0.52
▸ GNAI1 P63096 1/20 0.52
▸ DPP7 Q9UHL4 2/20 0.51
▸ RRM1 P23921 1/20 0.51
▸ SIRT6 Q8N6T7 1/20 0.48
▸ SIRT1 Q96EB6 1/20 0.48
▸ MMP8 P22894 1/20 0.46
▸ EPHX1 P07099 6/20 0.45
▸ SPHK1 Q9NYA1 3/20 0.44
▸ CNR1 P21554 1/20 0.44

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
SCHEMBL20169777 0.97 DPP7 (0.51) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL20072809 0.95 DPP7 (0.53) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL28285001 0.89 GNAI3 (0.58) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL28100557 0.89 GNAI3 (0.58) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL28052076 0.89 GNAI3 (0.58) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL28052266 0.89 GNAI3 (0.58) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL14874696 0.89 GNAI3 (0.58) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL20169778 0.88 DPP7 (0.39) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL21081679 0.86 DPP7 (0.56) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL28328772 0.85 DPP7 (0.62) GNAI3GNAO1GNAI1DPP7RRM1

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
WO-2018071033-A1 COACERVATE HYALURONAN HYDROGELS FOR DERMAL FILLER APPLICATIONS ALLERGAN, INC. (US) 2018-04-19 — — WO disclosed
Send feedback