SCHEMBL27194860

SCHEMBL27194860

O=C(O)N1CCC(n2c(=O)n(CCCCc3ccccc3)c3ccc(F)cc32)CC1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CACNA1G O43497 4/20 0.66
▸ CACNA1H O95180 4/20 0.66
▸ CYP3A4 P08684 6/20 0.45
▸ CYP2D6 P10635 3/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ HTR2A P28223 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
SCHEMBL24708742 0.89 CACNA1G (0.81) CACNA1GCACNA1HCYP3A4CYP2D6KDM4E
SCHEMBL27194858 0.89 CACNA1G (0.82) CACNA1GCACNA1HCYP3A4CYP2D6
SCHEMBL27194843 0.88 CACNA1G (0.66) CACNA1GCACNA1HCYP3A4CYP2D6CYP1A2
SCHEMBL24709335 0.88 CACNA1G (0.58) CACNA1GCACNA1HCYP3A4
SCHEMBL27194847 0.85 CACNA1G (0.77) CACNA1GCACNA1HCYP3A4CYP2D6
SCHEMBL27194859 0.82 CACNA1G (0.71) CACNA1GCACNA1HCYP3A4CYP2D6
SCHEMBL24708743 0.80 CACNA1G (0.87) CACNA1GCACNA1HCYP3A4CYP2D6KDM4E
SCHEMBL24708750 0.80 CACNA1G (0.87) CACNA1GCACNA1HCYP3A4CYP2D6KDM4E
SCHEMBL31000439 0.80 CACNA1G (0.87) CACNA1GCACNA1HCYP3A4CYP2D6KDM4E
SCHEMBL24709127 0.80 CACNA1G (1.00) CACNA1GCACNA1HCYP3A4CYP2D6

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
EP-4353713-A1 T-TYPE CALCIUM CHANNEL BLOCKER Kinki University (JP) 2024-04-17 — — EP disclosed
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