SCHEMBL24709126

SCHEMBL24709126

O=c1n(CCCCc2ccccc2)c2ccccc2n1C1CCN(CCCCc2cccc(Cl)c2)CC1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CACNA1G O43497 4/20 0.82
▸ CACNA1H O95180 4/20 0.82
▸ CYP2D6 P10635 4/20 0.51
▸ CYP3A4 P08684 3/20 0.51
▸ DRD2 P14416 4/20 0.49
▸ CYP1A2 P05177 3/20 0.49
▸ OPRM1 P35372 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ DRD3 P35462 2/20 0.49
▸ USP2 O75604 2/20 0.49
▸ SLC6A4 P31645 2/20 0.49
▸ SLC22A2 O15244 1/20 0.49
▸ NR1I2 O75469 1/20 0.49
▸ GMNN O75496 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ GLA P06280 1/20 0.49
▸ ADRB2 P07550 1/20 0.49
▸ ADRB1 P08588 1/20 0.49
▸ HTR1A P08908 1/20 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
SCHEMBL24708728 1.00 CACNA1G (0.82) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL31000419 1.00 CACNA1G (0.82) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL24709560 0.98 CACNA1G (0.78) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL24708732 0.91 CACNA1G (0.87) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL24709338 0.91 CACNA1G (0.87) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL30079694 0.91 CACNA1G (1.00) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL24708724 0.91 CACNA1G (1.00) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL24709353 0.90 CACNA1G (0.78) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL24708751 0.90 CACNA1G (0.78) CACNA1GCACNA1HCYP2D6CYP3A4DRD2
SCHEMBL24709104 0.90 CACNA1G (0.98) CACNA1GCACNA1HCYP2D6CYP3A4DRD2

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 2 patents. 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
WO-2022260016-A1 T-TYPE CALCIUM CHANNEL BLOCKER 学校法人近畿大学 2022-12-15 — — WO disclosed
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