SCHEMBL5801092

SCHEMBL5801092

CC(C)C(N)C(=O)N1CCC(Cc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 12/20 0.54
FPR2 P25090 1/20 0.45
PROKR1 Q8TCW9 1/20 0.45

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
SCHEMBL5743938 0.81 FAAH (0.57) CCR3
SCHEMBL5743942 0.81 FAAH (0.57) CCR3
SCHEMBL3354932 0.79 CCR3 (0.59) CCR3FPR2PROKR1
SCHEMBL4960083 0.79 CCR3 (0.53) CCR3FPR2PROKR1
SCHEMBL5743381 0.79 CCR3 (0.53) CCR3FPR2PROKR1
SCHEMBL4958711 0.77 KMT2A (0.56) CCR3
SCHEMBL4958716 0.77 KMT2A (0.56) CCR3
SCHEMBL5740997 0.77 KMT2A (0.56) CCR3
SCHEMBL4959461 0.77 CCR3 (0.57) CCR3FPR2PROKR1
SCHEMBL5744458 0.77 CCR3 (0.57) CCR3FPR2PROKR1

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-1680408-A2 CCR3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-07-19 EP disclosed
WO-2005040129-A2 CCR3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-05-06 WO disclosed
US-20050090504-A1 Piperidinyl and piperazinyl compounds substituted with bicyclo-heterocyclylalkyl groups useful as CCR3 receptor antagonists ROCHE PALO ALTO LLC 2005-04-28 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-20050090504-A1 Piperidinyl and piperazinyl compounds substituted with bicyclo-heterocyclylalkyl groups useful as CCR3 receptor antagonists CCR9, CCR3, CCR1 CCR3 2/4885FPR2 81/4885PROKR1 337/4885

“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.