SCHEMBL1343202

SCHEMBL1343202

CCC1C(=O)N(CCCN2CCCCC2)CCN1C(=O)C=Cc1ccc(F)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PYGL P06737 2/20 0.41
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
PAK1 Q13153 1/20 0.38
KCNH2 Q12809 1/20 0.38
KMT2A Q03164 1/20 0.37
ACHE P22303 3/20 0.36
BCHE P06276 1/20 0.36
MC4R P32245 1/20 0.36
MC5R P33032 1/20 0.36
MC3R P41968 1/20 0.36
MC1R Q01726 1/20 0.36
CCR2 P41597 3/20 0.36
HPGD P15428 1/20 0.36
GPR183 P32249 1/20 0.36
MAOB P27338 1/20 0.35

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
SCHEMBL1343198 1.00 PYGL (0.41) PYGLDRD2DRD3HRH3PAK1
SCHEMBL1343725 0.92 GPR183 (0.41) PYGLHRH3CCR2GPR183
SCHEMBL1343722 0.92 GPR183 (0.41) PYGLHRH3CCR2GPR183
SCHEMBL1344626 0.84 GPR183 (0.42) PYGLHRH3CCR2GPR183
SCHEMBL1344624 0.84 GPR183 (0.42) PYGLHRH3CCR2GPR183
SCHEMBL1345065 0.84 GPR183 (0.42) PYGLHRH3CCR2GPR183
SCHEMBL1345062 0.84 GPR183 (0.42) PYGLHRH3CCR2GPR183
SCHEMBL1344625 0.84 GPR183 (0.42) PYGLHRH3CCR2GPR183
SCHEMBL1343943 0.83 GPR183 (0.41) PYGLHRH3CCR2GPR183
SCHEMBL1343946 0.83 GPR183 (0.41) PYGLHRH3CCR2GPR183

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
US-8063042-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2011-11-22 US disclosed
US-20090023713-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE, INC. 2009-01-22 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-20090023713-A1 HETEROCYCLIC COMPOUNDS CCR5, CCR3, CCR2 PYGL 4073/4885DRD2 448/4885DRD3 201/4885

“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.