SCHEMBL22952979

SCHEMBL22952979

Oc1c(Cl)cc2c(c1O)Oc1cncc3c1C2CNC3

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.37
DRD1 P21728 1/20 0.37
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL22952974 0.86 DRD2 (0.30) DRD2DRD1
SCHEMBL22952971 0.81 HTR2A (0.35) DRD2DRD1
SCHEMBL22952975 0.80 DRD2 (0.36) DRD2DRD1SLC6A2SLC6A4SLC6A3
SCHEMBL22953385 0.77 DRD1 (0.36) DRD2DRD1SLC6A2SLC6A4SLC6A3
SCHEMBL22952972 0.77 DRD1 (0.34) DRD2DRD1SLC6A4
SCHEMBL22953345 0.70 DRD1 (0.34) DRD2DRD1SLC6A2SLC6A4SLC6A3
SCHEMBL22952978 0.67 DRD1 (0.34) DRD2DRD1SLC6A2SLC6A4SLC6A3
SCHEMBL22953387 0.65 DRD1 (0.35) DRD2DRD1SLC6A4
SCHEMBL29383649 0.64 HTR2A (0.46) DRD2DRD1
SCHEMBL6345215 0.64 HTR2A (0.46) DRD2DRD1

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-2021021922-A1 COMPOUNDS AND METHODS FOR TREATING FIBROTIC PATHOLOGIES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2021-02-04 WO disclosed