SCHEMBL27360376

SCHEMBL27360376

CCCCN1CCC(C)(F)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.46
S1PR3 Q99500 2/20 0.46
S1PR5 Q9H228 2/20 0.46
SIGMAR1 Q99720 7/20 0.42
S1PR4 O95977 1/20 0.41
EBP Q15125 1/20 0.41
GNAI3 P08754 2/20 0.39
GNAO1 P09471 2/20 0.39
GNAI1 P63096 2/20 0.39
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39

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
SCHEMBL25986150 0.94 S1PR1 (0.49) S1PR1S1PR3S1PR5SIGMAR1S1PR4
SCHEMBL19604912 0.92 S1PR1 (0.51) S1PR1S1PR3S1PR5SIGMAR1S1PR4
SCHEMBL13564381 0.86 KDM4E (0.40) S1PR1S1PR3S1PR5SIGMAR1DRD2
SCHEMBL22731513 0.85 HRH3 (0.41) S1PR1S1PR3S1PR5SIGMAR1GNAI3
SCHEMBL16263876 0.84 S1PR1 (0.47) S1PR1S1PR3S1PR5SIGMAR1S1PR4
SCHEMBL18506727 0.82 S1PR1 (0.49) S1PR1S1PR3S1PR5SIGMAR1S1PR4
SCHEMBL24114469 0.81 S1PR1 (0.34) S1PR1S1PR3S1PR5SIGMAR1S1PR4
SCHEMBL24293538 0.80 SIGMAR1 (0.33) S1PR1S1PR3S1PR5SIGMAR1
SCHEMBL22731574 0.79 HRH3 (0.37) S1PR1S1PR3S1PR5SIGMAR1
SCHEMBL22778761 0.78 S1PR1 (0.42) S1PR1S1PR3S1PR5SIGMAR1S1PR4

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-2024015863-A1 CBL-B INHIBITOR, COMPOSITIONS COMPRISING A CBL-B INHIBITOR IN A METHOD OF TREATING A DISEASE ASSOCIATED WITH CELL PROLIFERATION HOTSPOT THERAPEUTICS, INC. (US) 2024-01-18 WO disclosed