SCHEMBL4687244

SCHEMBL4687244

CCCN1CCO[C@@H](c2cccc3[nH]ncc23)C1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 9/20 0.49
PIK3CG P48736 1/20 0.40
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
IDO1 P14902 1/20 0.38
DRD2 P14416 1/20 0.38
SLC6A4 P31645 1/20 0.38
MET P08581 1/20 0.37

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
SCHEMBL4688203 1.00 DRD3 (0.49) DRD3PIK3CGROCK2ROCK1IDO1
SCHEMBL4689493 0.81 DRD3 (0.51) DRD3DRD2SLC6A4
SCHEMBL4686484 0.80 SLC6A4 (0.44) ROCK2ROCK1IDO1DRD2SLC6A4
SCHEMBL6360875 0.79 DRD2 (0.50) DRD3ROCK2ROCK1DRD2
SCHEMBL4686705 0.79 DRD2 (0.50) DRD3IDO1DRD2MET
SCHEMBL4683950 0.79 DRD2 (0.50) DRD3IDO1DRD2MET
SCHEMBL4684880 0.74 DRD2 (0.39) DRD3PIK3CGROCK2ROCK1IDO1
SCHEMBL4689438 0.74 DRD2 (0.39) DRD3PIK3CGROCK2ROCK1IDO1
SCHEMBL4687312 0.74 DRD2 (0.39) DRD3PIK3CGROCK2ROCK1IDO1
SCHEMBL4684082 0.73 MET (0.41) DRD3IDO1DRD2SLC6A4MET

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-1753763-B1 INDAZOLE AND INDOLONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS PFIZER LTD (GB) 2008-08-13 EP disclosed
EP-1753763-A2 INDAZOLE AND INDOLONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS Pfizer Limited (GB) 2007-02-21 EP disclosed
WO-2005116027-A2 INDAZOLE AND INDOLONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS PFIZER LIMTED (GB) 2005-12-08 WO 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 DRD3 2/4885PIK3CG 1861/4885ROCK2 1744/4885

“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.