SCHEMBL6360875

SCHEMBL6360875

CCCN1CCCC(c2cccc3[nH]ncc23)C1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.50
DRD4 P21917 4/20 0.50
DRD3 P35462 4/20 0.50
DRD1 P21728 3/20 0.50
DRD5 P21918 3/20 0.50
ROCK2 O75116 1/20 0.49
ROCK1 Q13464 1/20 0.49
SIGMAR1 Q99720 2/20 0.47
NFKB1 P19838 1/20 0.47
PRCP P42785 1/20 0.47
EBP Q15125 1/20 0.47

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
SCHEMBL4686484 0.87 SLC6A4 (0.44) DRD2ROCK2ROCK1
SCHEMBL11219877 0.81 DRD2 (0.52) DRD2DRD4DRD3DRD1DRD5
SCHEMBL4684082 0.80 MET (0.41) DRD2DRD4DRD3DRD1DRD5
SCHEMBL4684070 0.79 MET (0.45)
SCHEMBL4688203 0.79 DRD3 (0.49) DRD2DRD3ROCK2ROCK1
SCHEMBL4687244 0.79 DRD3 (0.49) DRD2DRD3ROCK2ROCK1
SCHEMBL3671316 0.77 TRPV1 (0.47) ROCK2ROCK1
SCHEMBL11230223 0.74 DRD4 (0.53) DRD2DRD4DRD3DRD1DRD5
SCHEMBL9671500 0.74 DRD2 (0.50) DRD2DRD4DRD3DRD1DRD5
SCHEMBL4687377 0.74 MET (0.42) DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753763-B1 INDAZOLE AND INDOLONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS PFIZER LTD (GB) 2008-08-13 EP disclosed
US-20050267096-A1 New indazole and indolone derivatives and their use pharmaceuticals PFIZER INC 2005-12-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050267096-A1 New indazole and indolone derivatives and their use pharmaceuticals DRD2, DRD3, DRD1 DRD2 1/4885DRD4 7/4885DRD3 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.