SCHEMBL9832753

SCHEMBL9832753

N#CC(C#N)=C1CCN(C2CC2)C1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL9829970 0.93 ALDH1A1 (0.35) DRD2DRD3
SCHEMBL10408223 0.91 ALDH1A1 (0.37) DRD2DRD3
SCHEMBL9830062 0.69 ALDH1A1 (0.35) DRD2DRD3
SCHEMBL9829972 0.67 DRD2 (0.36) DRD2DRD3
SCHEMBL10407364 0.66 CHRM5 (0.43)
SCHEMBL9830229 0.65 ALDH1A1 (0.40) DRD2DRD3
SCHEMBL9830255 0.63 DRD2 (0.39) DRD2DRD3
SCHEMBL2786474 0.63 ALDH1A1 (0.46) DRD2DRD3
SCHEMBL19684425 0.63 L3MBTL3 (0.31)
SCHEMBL9831065 0.61

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0449989-A1 6,7 DIHYDROPYRROLO 3,4-c] PYRIDO 2,3-d] PYRIMIDINE DERIVATIVES Sloan-Kettering Institute For Cancer Research (US) 1991-10-09 EP claimed
WO-1990007496-A1 6,7 DIHYDROPYRROLO[3,4-c] PYRIDO[2,3-d] PYRIMIDINE DERIVATIVES SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1990-07-12 WO claimed
US-4925939-A 6,7-dihydropyrrol[3,4-c]pyrido[2,3-d]pyrimidine derivatives SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1990-05-15 US disclosed