SCHEMBL3996326

SCHEMBL3996326

Clc1cccc(-c2[c]nccc2)c1C1CNCCO1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.37
DRD3 P35462 1/20 0.37
HTR2A P28223 1/20 0.36
CCNT1 O60563 1/20 0.35
CDK9 P50750 1/20 0.35
HTR2C P28335 1/20 0.35
HTR1A P08908 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
SCHEMBL3763673 0.81 DRD2 (0.37) DRD2DRD3HTR2AHTR1A
SCHEMBL444346 0.73 DRD2 (0.43) DRD2DRD3HTR2AHTR1A
SCHEMBL3754800 0.71 SLC6A2 (0.38) HTR2AHTR1A
SCHEMBL3766721 0.70 SSTR4 (0.38)
SCHEMBL3754892 0.69 SLC6A2 (0.36)
SCHEMBL28398541 0.69 DRD2 (0.43) DRD2DRD3HTR2AHTR1A
SCHEMBL3996423 0.68 SSTR4 (0.39)
SCHEMBL3770948 0.68 SLC6A2 (0.35) HTR2AHTR1A
SCHEMBL1965907 0.67 CYP2A6 (0.40)
SCHEMBL1639063 0.65 DRD2 (0.46) DRD2DRD3HTR2AHTR1A

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-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed