SCHEMBL9801745

SCHEMBL9801745

CCCCCCCCCCCCCCCCCCCCNC1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GNAI3 P08754 2/20 0.63
▸ GNAO1 P09471 2/20 0.63
▸ GNAI1 P63096 2/20 0.63
▸ EPHX1 P07099 11/20 0.56
▸ EPHX2 P34913 2/20 0.56
▸ S1PR4 O95977 2/20 0.54
▸ S1PR1 P21453 2/20 0.54
▸ S1PR3 Q99500 2/20 0.54
▸ S1PR5 Q9H228 1/20 0.54
▸ NAAA Q02083 1/20 0.50
▸ SIGMAR1 Q99720 2/20 0.49

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
SCHEMBL6063483 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL9801035 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL3681610 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL9801360 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL9801666 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL3692945 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL20975893 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL22472718 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL20991764 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL3687837 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1EPHX1EPHX2

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-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 — — US disclosed
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