SCHEMBL31066880

SCHEMBL31066880

CCCCCCCCCCCCCNC1CCN(C)CC1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 6/20 0.58
GNAO1 P09471 6/20 0.58
GNAI1 P63096 6/20 0.58
GBA1 P04062 6/20 0.46
S1PR4 O95977 2/20 0.45
S1PR1 P21453 2/20 0.45
S1PR3 Q99500 2/20 0.45
S1PR5 Q9H228 1/20 0.43
EPHX2 P34913 1/20 0.41
EHMT2 Q96KQ7 4/20 0.41
EHMT1 Q9H9B1 4/20 0.41

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
SCHEMBL31066865 1.00 GNAI3 (0.58) GNAI3GNAO1GNAI1GBA1S1PR4
SCHEMBL24803090 1.00 GNAI3 (0.58) GNAI3GNAO1GNAI1GBA1S1PR4
SCHEMBL26042870 1.00 GNAI3 (0.58) GNAI3GNAO1GNAI1GBA1S1PR4
SCHEMBL21949297 1.00 GNAI3 (0.58) GNAI3GNAO1GNAI1GBA1S1PR4
SCHEMBL31066862 1.00 GNAI3 (0.58) GNAI3GNAO1GNAI1GBA1S1PR4
SCHEMBL25448549 0.98 GNAI3 (0.55) GNAI3GNAO1GNAI1GBA1S1PR4
SCHEMBL13301319 0.92 GNAI3 (0.47) GNAI3GNAO1GNAI1S1PR4S1PR1
SCHEMBL24072425 0.89 GNAI3 (0.50) GNAI3GNAO1GNAI1GBA1S1PR4
SCHEMBL4623536 0.84 MEN1 (0.43) GNAI3GNAO1GNAI1
SCHEMBL24210534 0.83 GNAI3 (0.70) GNAI3GNAO1GNAI1GBA1S1PR4

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-2024181373-A1 METHOD FOR SELECTIVELY MODIFYING SUBSTRATE SURFACE, METHOD FOR PRODUCING SURFACE-TREATED SUBSTRATE, AND COMPOSITION JSR株式会社 2024-09-06 WO disclosed