SCHEMBL15032044

SCHEMBL15032044

Cc1c(Cl)ncnc1C(=O)N1CCC(N2CCO[C@@H]3COCC[C@@H]32)CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.40
CCR3 P51677 2/20 0.33
CCR5 P51681 2/20 0.31
PIK3CD O00329 1/20 0.31
PIK3R1 P27986 1/20 0.31
IRAK4 Q9NWZ3 2/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
FASN P49327 1/20 0.30
CYP2C19 P33261 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL15032042 1.00 CCR2 (0.40) CCR2CCR3CCR5PIK3CDPIK3R1
SCHEMBL15033734 0.83 CCR2 (0.63) CCR2CCR5
SCHEMBL10178369 0.77 L3MBTL3 (0.50) CCR2CCR5PIK3CDKMT2AMEN1
SCHEMBL15033677 0.77 CCR2 (0.46) CCR2CCR5PIK3CDPIK3R1POLB
SCHEMBL15032046 0.75 CCR2 (0.61) CCR2CCR5
SCHEMBL15032049 0.75 CCR2 (0.61) CCR2CCR5
SCHEMBL15033670 0.75 CCR2 (0.46) CCR2CCR5IRAK4
SCHEMBL15032057 0.74 CCR2 (0.48) CCR2CCR5
SCHEMBL15033681 0.74 CCR2 (0.52) CCR2CCR5CYP2C19
SCHEMBL15033674 0.73 CCR2 (0.53) CCR2CCR5

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-2721025-B1 NEW SELECTIVE CCR2 ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2015-11-25 EP disclosed
US-20130150354-A1 NEW SELECTIVE CCR2 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-13 US disclosed
US-20130150354-A1 NEW SELECTIVE CCR2 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-13 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-20130150354-A1 NEW SELECTIVE CCR2 ANTAGONISTS CCR2, CCRL2, CXCR2 CCR2 1/4885CCR3 7/4885CCR5 6/4885

“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.