SCHEMBL11564641

SCHEMBL11564641

COCC1(Nc2ccccc2)CCN(CCCc2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPFFR1 Q9GZQ6 1/20 0.53
NPFFR2 Q9Y5X5 1/20 0.53
SIGMAR1 Q99720 6/20 0.51
SMN1; SMN2 Q16637 1/20 0.49
KCNA3 P22001 1/20 0.46
FAAH O00519 1/20 0.46

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
SCHEMBL9148987 0.92 NPFFR1 (0.61) NPFFR1NPFFR2SIGMAR1SMN1; SMN2
Hydrochloric Acid SCHEMBL11565432 0.91 NPFFR1 (0.60) NPFFR1NPFFR2SIGMAR1SMN1; SMN2
SCHEMBL11569035 0.87 DRD2 (0.46) NPFFR1NPFFR2SIGMAR1
SCHEMBL11566761 0.85 NPFFR1 (0.54) NPFFR1NPFFR2SIGMAR1SMN1; SMN2
SCHEMBL11566101 0.85 SIGMAR1 (0.46) NPFFR1NPFFR2SIGMAR1
SCHEMBL11567248 0.84 SIGMAR1 (0.55) NPFFR1NPFFR2SIGMAR1SMN1; SMN2
SCHEMBL11563945 0.84 NPFFR1 (0.53) NPFFR1NPFFR2SIGMAR1SMN1; SMN2
SCHEMBL11566955 0.84 NPFFR1 (0.53) NPFFR1NPFFR2SIGMAR1SMN1; SMN2
SCHEMBL11566486 0.84 SIGMAR1 (0.55) NPFFR1NPFFR2SIGMAR1SMN1; SMN2
SCHEMBL3167579 0.84 NPFFR1 (0.60) NPFFR1NPFFR2SIGMAR1

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
US-4179569-A ANALGESIC INTERMEDIATES JANSSEN PHARMACEUTICA N.V. (BE) 1979-12-18 US disclosed