SCHEMBL3131473

SCHEMBL3131473

Fc1cc(COC2CCN(N3CCC(OCc4cccc(C(F)(F)F)c4F)CC3)CC2)ccc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 5/20 0.44
PRMT6 Q96LA8 5/20 0.44
DRD4 P21917 15/20 0.40
SIGMAR1 Q99720 15/20 0.40
DRD3 P35462 6/20 0.40
TMEM97 Q5BJF2 5/20 0.40
PRMT8 Q9NR22 1/20 0.38

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
SCHEMBL3131468 0.87 SLC6A2 (0.47) CARM1PRMT6DRD4SIGMAR1DRD3
SCHEMBL3122265 0.74 KIF11 (0.39) CARM1PRMT6DRD4SIGMAR1DRD3
SCHEMBL26933596 0.70 KDM1A (0.47) DRD4SIGMAR1
SCHEMBL26933602 0.70 KDM1A (0.47) DRD4SIGMAR1
SCHEMBL30636293 0.70 KDM1A (0.47) DRD4SIGMAR1
Hydrochloric Acid SCHEMBL30636281 0.69 KDM1A (0.46) DRD4SIGMAR1
SCHEMBL29277445 0.69 MGLL (0.41) DRD4
SCHEMBL3129510 0.67 CARM1 (0.50) CARM1PRMT6DRD4SIGMAR1DRD3
SCHEMBL25738425 0.67 KIF11 (0.50) DRD4
SCHEMBL30754900 0.65 CARM1 (0.60) CARM1PRMT6

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-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 WO disclosed