SCHEMBL9415938

SCHEMBL9415938

CCCCCCCCCCCCCCCCN(CCN)Cc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.57
MAPT P10636 1/20 0.53
CARM1 Q86X55 1/20 0.51
PRMT6 Q96LA8 1/20 0.51
PRMT8 Q9NR22 1/20 0.51
BCHE P06276 3/20 0.48
DRD2 P14416 1/20 0.48
OPRM1 P35372 1/20 0.48
DRD3 P35462 1/20 0.48
OPRD1 P41143 1/20 0.48
OPRK1 P41145 1/20 0.48
ACHE P22303 1/20 0.47

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
SCHEMBL9415960 1.00 KCNH2 (0.57) KCNH2MAPTCARM1PRMT6PRMT8
SCHEMBL9415994 1.00 KCNH2 (0.57) KCNH2MAPTCARM1PRMT6PRMT8
SCHEMBL9415950 1.00 KCNH2 (0.57) KCNH2MAPTCARM1PRMT6PRMT8
SCHEMBL9415896 1.00 KCNH2 (0.57) KCNH2MAPTCARM1PRMT6PRMT8
SCHEMBL9005882 0.91 KCNH2 (0.66) KCNH2MAPTBCHEDRD2OPRM1
SCHEMBL11359571 0.91 KCNH2 (0.66) KCNH2MAPTBCHEDRD2OPRM1
SCHEMBL7606887 0.91 KCNH2 (0.66) KCNH2MAPTBCHEDRD2OPRM1
SCHEMBL9005868 0.91 KCNH2 (0.66) KCNH2MAPTBCHEDRD2OPRM1
SCHEMBL1262236 0.91 KCNH2 (0.66) KCNH2MAPTBCHEDRD2OPRM1
SCHEMBL1260761 0.91 KCNH2 (0.66) KCNH2MAPTBCHEDRD2OPRM1

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-0599265-A1 Antibacterial, antifungal compound and its production method Takeda Chemical Industries, Ltd. (JP) 1994-06-01 EP disclosed