SCHEMBL9848581

SCHEMBL9848581

CCCn1ccc2cc(F)c(N3C(=O)C4=C(CCCC4)C3=O)cc21

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
GRM7 Q14831 3/20 0.39
GRM4 Q14833 3/20 0.39
GRM1 Q13255 1/20 0.39

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
SCHEMBL9848561 0.90 GRM7 (0.40) GRM7GRM4GRM1
SCHEMBL9848554 0.79 GRM7 (0.37) GRM7GRM4GRM1
SCHEMBL9848591 0.78 GRM7 (0.42) GRM7GRM4GRM1
SCHEMBL8349482 0.69 HTR2C (0.53) HTR2AHTR2C
SCHEMBL10338402 0.68 CHRM1 (0.42) GRM7GRM4
SCHEMBL21872466 0.68 HTR2C (0.54) HTR2AHTR2C
SCHEMBL9848585 0.67 GPR84 (0.47) GRM7GRM4GRM1
SCHEMBL10615889 0.66 PARK7 (0.50) GRM7GRM4GRM1
SCHEMBL11721047 0.66 GRM7 (0.43) GRM7GRM4GRM1
SCHEMBL9823500 0.65 GRM7 (0.46) GRM7GRM4GRM1

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-0409025-A2 N-[Indol-6-yl]-heterocyclic compounds BAYER AG (DE) 1991-01-23 EP claimed
EP-0409025-A2 N-[Indol-6-yl]-heterocyclic compounds BAYER AG (DE) 1991-01-23 EP disclosed