SCHEMBL7501327

SCHEMBL7501327

c1c2c(cc3c1[N]CC3)NCC2

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
AR P10275 2/20 0.33
GFER P55789 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL4496862 0.78 DRD2 (0.56) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL6582387 0.72 DRD2 (0.50) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL4504545 0.69 DRD2 (0.47) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL21678125 0.66
SCHEMBL13154646 0.65 DRD2 (0.44) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL2265794 0.64 DRD2 (0.47) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL93915 0.64 DRD2 (0.57) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL29358285 0.64 DRD2 (0.57) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL8261456 0.64 DRD2 (0.47) DRD2DRD4ALDH1A1MAPTAR
SCHEMBL8529795 0.64 DRD2 (0.52) DRD2DRD4ALDH1A1MAPTAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888349-B1 PYRROLOPYRIMIDINES AND PROCESSES FOR THEIR PREPARATION NOVARTIS AG (CH) 2002-05-22 EP claimed
US-6140317-A AS INHIBITORS OF PROTEIN KINASES AND HAVE ANTITUMOUR ACTIVITY NOVARTIS AG (CH) 2000-10-31 US claimed
EP-0888349-B1 PYRROLOPYRIMIDINES AND PROCESSES FOR THEIR PREPARATION NOVARTIS AG (CH) 2002-05-22 EP disclosed
US-6140317-A AS INHIBITORS OF PROTEIN KINASES AND HAVE ANTITUMOUR ACTIVITY NOVARTIS AG (CH) 2000-10-31 US disclosed