SCHEMBL11565877

SCHEMBL11565877

Cc1ccc(NC2(CO)CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPFFR1 Q9GZQ6 4/20 0.57
NPFFR2 Q9Y5X5 4/20 0.57
POLB P06746 3/20 0.55
LMNA P02545 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 2/20 0.49
OPRK1 P41145 1/20 0.49
MAPK1 P28482 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
FAAH O00519 1/20 0.47
OPRL1 P41146 1/20 0.47
ACHE P22303 1/20 0.46
BACE1 P56817 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
SCHEMBL3178014 0.90 NPFFR1 (0.67) NPFFR1NPFFR2POLBALDH1A1OPRK1
Hydrochloric Acid SCHEMBL6123389 0.90 NPFFR1 (0.67) NPFFR1NPFFR2POLBALDH1A1OPRK1
SCHEMBL11566400 0.87 NPFFR1 (0.57) NPFFR1NPFFR2POLBALDH1A1OPRK1
SCHEMBL7834387 0.86 ALDH1A1 (0.55) NPFFR1NPFFR2POLBLMNASMN1; SMN2
SCHEMBL11565487 0.86 SIGMAR1 (0.58) NPFFR1NPFFR2POLBALDH1A1OPRK1
SCHEMBL11447239 0.85 POLB (0.52) NPFFR1NPFFR2POLBLMNASMN1; SMN2
SCHEMBL11567112 0.81 FAAH (0.55) NPFFR1NPFFR2POLBLMNASMN1; SMN2
SCHEMBL3939085 0.79 CYP2D6 (0.65) NPFFR1NPFFR2POLBLMNASMN1; SMN2
SCHEMBL8206701 0.79 NPFFR1 (0.54) NPFFR1NPFFR2POLBSMN1; SMN2ALDH1A1
SCHEMBL11564980 0.78 NPFFR1 (0.65) NPFFR1NPFFR2LMNASMN1; SMN2ALDH1A1

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