SCHEMBL15033734

SCHEMBL15033734

Cc1c(Nc2ccc(Cl)c(Cl)c2)ncnc1C(=O)N1CCC(N2CCO[C@H]3COCC[C@H]32)CC1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.63
CCR5 P51681 1/20 0.48
EPHA2 P29317 13/20 0.40
KDR P35968 12/20 0.40
EPHB4 P54760 5/20 0.39
EGFR P00533 4/20 0.39
ERBB2 P04626 2/20 0.39
FLT1 P17948 1/20 0.38

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
SCHEMBL15033681 0.89 CCR2 (0.52) CCR2CCR5EPHA2KDREGFR
SCHEMBL15033672 0.88 CCR2 (0.53) CCR2CCR5EPHA2KDREPHB4
SCHEMBL15033674 0.88 CCR2 (0.53) CCR2CCR5EPHA2KDREPHB4
SCHEMBL14318471 0.87 CCR2 (0.50) CCR2CCR5EPHA2KDREPHB4
SCHEMBL14318481 0.87 CCR2 (0.50) CCR2CCR5EPHA2KDREPHB4
SCHEMBL15033677 0.85 CCR2 (0.46) CCR2CCR5KDREGFR
SCHEMBL15032042 0.83 CCR2 (0.40) CCR2CCR5
SCHEMBL15032044 0.83 CCR2 (0.40) CCR2CCR5
SCHEMBL14325814 0.81 CCR2 (0.64) CCR2CCR5EPHA2KDREPHB4
SCHEMBL16257561 0.80 CCR2 (0.78) CCR2CCR5EPHA2KDREPHB4

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
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

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 1/4885CCR5 6/4885EPHA2 854/4885

“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.