SCHEMBL22952974

SCHEMBL22952974

Oc1c(Br)cc2c(c1O)Oc1cncc3c1C2CNC3

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.30
DRD1 P21728 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
SCHEMBL22952979 0.86 DRD2 (0.37) DRD2DRD1
SCHEMBL22952971 0.81 HTR2A (0.35) DRD2DRD1
SCHEMBL22952969 0.77 HTR2A (0.35) DRD2DRD1
SCHEMBL22953346 0.70 PARP1 (0.33) DRD2DRD1
SCHEMBL22952975 0.66 DRD2 (0.36) DRD2DRD1
SCHEMBL29383649 0.64 HTR2A (0.46) DRD2DRD1
SCHEMBL6345215 0.64 HTR2A (0.46) DRD2DRD1
SCHEMBL22952980 0.64 SLC6A4 (0.32)
SCHEMBL22952972 0.64 DRD1 (0.34) DRD2DRD1
Bromide SCHEMBL3668719 0.64 HTR2A (0.45) 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