SCHEMBL4249979

SCHEMBL4249979

CCCCN1C[C@@H](c2ccc(N)nc2)OC[C@@H]1C

nearest known ligand 0.88

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 0.88
DRD3 P35462 20/20 0.88
DRD4 P21917 3/20 0.88
OPRM1 P35372 2/20 0.48

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
SCHEMBL5177150 1.00 DRD2 (0.88) DRD2DRD3DRD4OPRM1
SCHEMBL4242439 1.00 DRD2 (0.88) DRD2DRD3DRD4OPRM1
SCHEMBL12661863 0.94 DRD2 (1.00) DRD2DRD3DRD4OPRM1
SCHEMBL1842073 0.94 DRD2 (1.00) DRD2DRD3DRD4OPRM1
SCHEMBL1840932 0.94 DRD2 (1.00) DRD2DRD3DRD4OPRM1
SCHEMBL5188361 0.94 DRD2 (1.00) DRD2DRD3DRD4OPRM1
Water SCHEMBL1841645 0.93 DRD2 (0.97) DRD2DRD3DRD4OPRM1
SCHEMBL4238881 0.88 DRD2 (0.83) DRD2DRD3DRD4OPRM1
SCHEMBL4238880 0.88 DRD2 (0.83) DRD2DRD3DRD4OPRM1
SCHEMBL4388560 0.88 DRD2 (0.83) DRD2DRD3DRD4OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090005354-A1 New Amino Derivatives and Their Use as Pharmaceuticals PFIZER, INC. (US) 2009-01-01 US disclosed
US-20090005354-A1 New Amino Derivatives and Their Use as Pharmaceuticals PFIZER, INC. (US) 2009-01-01 US disclosed
US-20090005354-A1 New Amino Derivatives and Their Use as Pharmaceuticals PFIZER, INC. (US) 2009-01-01 US disclosed
EP-1758862-A1 AMINOPYRIDINE DERIVATIVES AS SELECTIVE DOPAMINE D3 AGONISTS Pfizer Limited (GB) 2007-03-07 EP disclosed
US-20050288270-A1 New aminopyridine derivatives and their use as pharmaceuticals PFIZER INC 2005-12-29 US disclosed
WO-2005115985-A1 AMINOPYRIDINE DERIVATIVES AS SELECTIVE DOPAMINE D3 AGONISTS PFIZER LIMITED (GB) 2005-12-08 WO 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 (2 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-20050288270-A1 New aminopyridine derivatives and their use as pharmaceuticals DRD2, DRD1, DRD3 DRD2 1/4885DRD3 3/4885DRD4 5/4885
US-20090005354-A1 New Amino Derivatives and Their Use as Pharmaceuticals DRD2, DRD1, DRD3 DRD2 1/4885DRD3 3/4885DRD4 4/4885

“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.