SCHEMBL14560427

SCHEMBL14560427

CCCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.78
CNR1 P21554 3/20 0.75
SIGMAR1 Q99720 7/20 0.63
HRH1 P35367 1/20 0.61
HRH3 Q9Y5N1 1/20 0.61
POLB P06746 1/20 0.57
TDP1 Q9NUW8 1/20 0.54

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
SCHEMBL8723082 0.94 CNR1 (0.74) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL20290801 0.93 CNR1 (0.70) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL20290800 0.93 CNR1 (0.70) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL20290109 0.93 CNR1 (0.70) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL11885815 0.88 POLB (0.63) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL14104950 0.86 FAAH (0.70) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL11421096 0.84 HRH1 (0.63) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL10754550 0.84 HRH1 (0.63) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL14560430 0.83 CNR1 (0.60) FAAHCNR1SIGMAR1HRH1HRH3
SCHEMBL7904117 0.83 SIGMAR1 (0.60) FAAHCNR1SIGMAR1HRH1HRH3

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-7192967-B1 Cyclic imide-substituted pyridylalkane, alkene, alkine carboxamides useful as cytostatic and immunosuppressive agents ASTELLAS PHARMA GMBH (DE) 2007-03-20 US disclosed