SCHEMBL24970443

SCHEMBL24970443

Cc1ccn(C(=O)N2CCN(Cc3ccc(C(F)(F)F)cc3-c3nnn[nH]3)CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.51
MGLL Q99685 4/20 0.48
CYP2D6 P10635 1/20 0.38
ABHD6 Q9BV23 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
SCHEMBL30302105 0.89 FAAH (0.66) FAAHMGLL
SCHEMBL20566964 0.89 FAAH (0.66) FAAHMGLL
SCHEMBL21271341 0.86 FAAH (0.46) FAAHMGLL
SCHEMBL20567002 0.86 FAAH (0.54) FAAHMGLL
SCHEMBL30302067 0.86 FAAH (0.54) FAAHMGLL
SCHEMBL20571297 0.83 MGLL (0.45) FAAHMGLLCYP2D6ABHD6
SCHEMBL31483872 0.80 MGLL (0.49) MGLLCYP2D6ABHD6
SCHEMBL20567724 0.80 MGLL (0.49) MGLLCYP2D6ABHD6
SCHEMBL24970070 0.79 FAAH (0.78) FAAHMGLLCYP2D6ABHD6
SCHEMBL25487182 0.79 FAAH (0.58) FAAHMGLL

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023006893-A1 COMPOUNDS FOR THE TREATMENT OF PAIN, IN PARTICULAR NEUROPATHIC PAIN, AND/OR OTHER DISEASES OR DISORDERS THAT ARE ASSOCIATED WITH AT2R AND/OR AT2R MEDIATED SIGNALING CONFO THERAPEUTICS N.V. (BE) 2023-02-02 WO disclosed
EP-3630744-B1 PYRAZOLE MAGL INHIBITORS H LUNDBECK AS (DK) 2023-01-25 EP disclosed