SCHEMBL8916599

SCHEMBL8916599

CCc1nn(N2CCC(CC(=O)c3ccc(F)cc3)C2)c2ccc(Cl)cc12

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.41
HTR2A P28223 2/20 0.41
HTR2C P28335 2/20 0.41
HTR2B P41595 2/20 0.41
SIGMAR1 Q99720 2/20 0.41
KCNH2 Q12809 2/20 0.38
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
MAPK10 P53779 1/20 0.35

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
Hydrochloric Acid SCHEMBL8918821 0.99 DRD2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL8916603 0.76 DRD2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
Hydrochloric Acid SCHEMBL8918825 0.76 DRD2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL8309921 0.69 DRD2 (0.45) DRD2HTR2AHTR2CHTR2BSIGMAR1
Hydrochloric Acid SCHEMBL8916089 0.67 DRD2 (0.43) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL8916231 0.67 DRD2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
Hydrochloric Acid SCHEMBL8917061 0.67 DRD2 (0.41) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL8916558 0.64 DRD2 (0.40) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL8557302 0.64 DRD2 (0.54) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL9870941 0.64 DRD2 (0.57) DRD2HTR2AHTR2CHTR2BSIGMAR1

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-5703070-A PSYCHOLOGICAL DISORDERS ADIR ET COMPAGNIE (FR) 1997-12-30 US disclosed