SCHEMBL24468296

SCHEMBL24468296

C[C@@H](NCCC(C)(C)C)c1ccc(C(F)F)cn1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CACNA1I Q9P0X4 2/20 0.35
CACNA1G O43497 1/20 0.35
CACNA1H O95180 1/20 0.35
CNR2 P34972 1/20 0.35
KCNH2 Q12809 1/20 0.35
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL24468294 0.80 CACNA1I (0.36) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL29106431 0.80 CACNA1I (0.36) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL5131540 0.74 KDM4E (0.38) KCNH2
SCHEMBL29686184 0.71 CACNA1I (0.33) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL29106427 0.71 CACNA1I (0.33) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL29106411 0.71 CACNA1I (0.33) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL29685834 0.71 CACNA1I (0.33) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL29106407 0.71 CACNA1I (0.33) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL30615171 0.71 CACNA1I (0.33) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL29106408 0.71 CACNA1I (0.33) CACNA1ICACNA1GCACNA1HCNR2KCNH2

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-2022115377-A1 TRICYCLIC CARBOXAMIDE DERIVATIVES AS PRMT5 INHIBITORS AMGEN INC. (US) 2022-06-02 WO disclosed