SCHEMBL2139012

SCHEMBL2139012

CCc1[nH]c2cc(F)ccc2c1C1CCN(CCCSc2ccc(F)cc2)CC1.COc1ccc(C)nc1-n1ccc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 20/20 0.65

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
SCHEMBL1097478 0.80 CCR3 (1.00) CCR3
SCHEMBL1097888 0.76 CCR3 (1.00) CCR3
SCHEMBL13797759 0.74 CCR3 (0.86) CCR3
SCHEMBL4129858 0.72 CCR3 (0.81) CCR3
SCHEMBL10094950 0.70 CCR3 (0.70) CCR3
SCHEMBL10094949 0.69 CCR3 (0.69) CCR3
SCHEMBL4001590 0.67 CCR3 (0.69) CCR3
SCHEMBL4000148 0.67 CCR3 (1.00) CCR3
SCHEMBL3994282 0.67 CCR3 (0.70) CCR3
SCHEMBL1107160 0.66 CCR3 (0.82) CCR3

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
US-8148403-B2 Substituted piperidyl-propane-thiols BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-03 US disclosed
EP-2079731-B1 NOVEL SUBSTITUTED PIPERIDYL-PROPANE-THIOLS BOEHRINGER INGELHEIM INT (DE) 2011-09-14 EP disclosed
US-20100317669-A1 NOVEL SUBSTITUTED PIPERIDYL-PROPANE-THIOLS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-12-16 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-20100317669-A1 NOVEL SUBSTITUTED PIPERIDYL-PROPANE-THIOLS CCR3, CCR1, CCRL2 CCR3 1/4885

“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.