SCHEMBL6198271

SCHEMBL6198271

Cc1nc2c(s1)CCc1cnn(CCO)c1-2

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 6/20 0.38
DRD2 P14416 5/20 0.38
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
CDK19 Q9BWU1 1/20 0.31
FBP1 P09467 1/20 0.31

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
SCHEMBL6194117 0.76 DRD4 (0.38) DRD4DRD2
SCHEMBL6195098 0.71 PLK4 (0.40) DRD4DRD2CDK8
SCHEMBL6199867 0.71 DRD4 (0.38) DRD4DRD2
SCHEMBL6200590 0.71 DRD4 (0.33) DRD4DRD2
SCHEMBL6195844 0.71 HTR2C (0.34) DRD4DRD2
SCHEMBL6197590 0.69 DRD4 (0.35) DRD4DRD2
SCHEMBL6196389 0.66 DRD4 (0.38) DRD4DRD2
SCHEMBL6195101 0.66 KDM4E (0.41) DRD4DRD2
SCHEMBL6199260 0.64 KDM4E (0.44) DRD4DRD2
SCHEMBL6199771 0.62 MAPT (0.68)

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-0990650-B1 TRICYCLIC PYRROLE OR PYRAZOLE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2005-08-17 EP disclosed
US-6245796-B1 NERVOUS SYSTEM DISORDERS; SEXUAL DISORDERS; SLEEP DISORDERS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-12 US disclosed
EP-0990650-A1 TRICYCLIC PYRROLE OR PYRAZOLE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2000-04-05 EP disclosed