SCHEMBL20195133

SCHEMBL20195133

CCn1c(=O)cc(C2=CCN(C)CC2)c2cc(C=O)ccc21

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 4/20 0.44
HTR6 P50406 4/20 0.38
GRM2 Q14416 1/20 0.38
SLC6A4 P31645 1/20 0.37

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
SCHEMBL21474013 0.82 HPGD (0.47) HTR6GRM2
SCHEMBL20183533 0.75 KDM4E (0.43) HTR6
SCHEMBL20183527 0.74 CNR2 (0.43) HTR6
SCHEMBL20183592 0.74 HTR6 (0.39) HTR6SLC6A4
SCHEMBL28325696 0.72 GRM2 (0.38) HTR6GRM2
SCHEMBL20183657 0.72 PDE4A (0.45)
SCHEMBL7804263 0.71 SLC6A4 (0.71) HTR6SLC6A4
SCHEMBL20195235 0.71 HTR6 (0.35) HTR6SLC6A4
SCHEMBL20195076 0.71 PTGER4 (0.65) PTGER4
SCHEMBL20195210 0.70 SLC6A4 (0.33) HTR6GRM2SLC6A4

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
EP-3327004-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORP (JP) 2020-11-04 EP disclosed
EP-3327004-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND Fujifilm Corporation (JP) 2018-05-30 EP disclosed