SCHEMBL24985173

SCHEMBL24985173

CCCCOC(=O)NS(=O)(=O)c1ccc(C(F)(F)F)cc1N1CCN(Cc2nc3ccccc3n2C)CC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 5/20 0.51
DRD4 P21917 4/20 0.51
AGTR2 P50052 15/20 0.51
AGTR1 P30556 8/20 0.50
DRD2 P14416 1/20 0.46
DRD3 P35462 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
SCHEMBL30164155 1.00 GRM2 (0.51) GRM2DRD4AGTR2AGTR1DRD2
SCHEMBL29232145 0.93 GRM2 (0.54) GRM2DRD4DRD2DRD3
SCHEMBL30164146 0.93 GRM2 (0.54) GRM2DRD4DRD2DRD3
SCHEMBL30164125 0.90 AGTR2 (0.54) GRM2AGTR2AGTR1
SCHEMBL29232389 0.90 AGTR2 (0.54) GRM2AGTR2AGTR1
SCHEMBL24985229 0.88 GRM2 (0.52) GRM2DRD4DRD2DRD3
SCHEMBL30163934 0.88 GRM2 (0.52) GRM2DRD4DRD2DRD3
SCHEMBL30164034 0.80 GRM2 (0.64) GRM2DRD4DRD2DRD3
SCHEMBL24985228 0.77 LMNA (0.50) GRM2DRD4
SCHEMBL30164061 0.77 LMNA (0.50) GRM2DRD4

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
CN-118159530-A Compounds for the treatment of pain, in particular neuropathic pain and/or other diseases or disorders associated with AT2R and/or AT2R mediated signalling 康福治疗有限公司 2024-06-07 CN disclosed
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