SCHEMBL3376493

SCHEMBL3376493

CCN1CCC(c2ccccc2-c2cc(C)ccc2OC)C1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.47
HTR7 P34969 2/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
DRD4 P21917 2/20 0.43
HTR2A P28223 1/20 0.41
CHRM3 P20309 2/20 0.41
ATM Q13315 1/20 0.41
CCNT1 O60563 1/20 0.41
CDK9 P50750 1/20 0.41

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
SCHEMBL2273802 0.85 HTR2A (0.53) DRD2HTR7HTR2ACHRM3ATM
SCHEMBL2279423 0.74 HTR2A (0.52) HTR7HTR2ACCNT1CDK9
SCHEMBL8304330 0.72 DRD2 (0.78) DRD2HTR7MEN1KMT2ADRD4
SCHEMBL10276962 0.72 HTR2C (0.47) DRD2KMT2ADRD4
SCHEMBL12125022 0.71 DRD2 (0.59) DRD2MEN1KMT2ADRD4HTR2A
SCHEMBL2271779 0.71 HTR1A (0.63) DRD2HTR7MEN1KMT2ADRD4
SCHEMBL17840333 0.67 CHRM3 (0.40) CHRM3
SCHEMBL17840227 0.67 CHRM3 (0.40) CHRM3
SCHEMBL3958057 0.67 ACHE (0.52) HTR7
SCHEMBL30878617 0.67 DRD3 (0.65) DRD2DRD4

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
WO-2010059390-A1 MODULATORS OF SEROTONIN RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2010-05-27 WO claimed