SCHEMBL15033677

SCHEMBL15033677

Cc1c(Nc2cccc(C(F)(F)F)c2)ncnc1C(=O)N1CCC(N2CCO[C@H]3COCC[C@H]32)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.46
CNR2 P34972 1/20 0.42
EGFR P00533 5/20 0.41
ABL1 P00519 2/20 0.39
BCR P11274 2/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2A P28223 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39
SLC6A3 Q01959 1/20 0.39
PDE4D Q08499 1/20 0.39
KCNH2 Q12809 1/20 0.39
TP53 P04637 1/20 0.39
PIK3CD O00329 1/20 0.38
PIK3R1 P27986 1/20 0.38
GPR52 Q9Y2T5 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL15033679 0.90 CNR2 (0.41) CCR2CNR2SLC6A2HTR2AOPRK1
SCHEMBL15033680 0.89 CCR2 (0.40) CCR2CNR2EGFRABL1BCR
SCHEMBL15033671 0.89 CCR2 (0.40) CCR2CNR2EGFRABL1BCR
SCHEMBL15033761 0.88 CCR2 (0.41) CCR2CNR2EGFRSLC6A2HTR2A
SCHEMBL15033726 0.88 CCR2 (0.41) CCR2CNR2EGFRSLC6A2HTR2A
SCHEMBL17278071 0.88 CCR2 (0.41) CCR2CNR2EGFRSLC6A2HTR2A
SCHEMBL15033734 0.85 CCR2 (0.63) CCR2EGFRKDRCCR5
SCHEMBL16257547 0.83 CNR2 (0.51) CCR2CNR2EGFRSLC6A2HTR2A
SCHEMBL12180206 0.79 CCR2 (0.74) CCR2EGFRKCNH2CCR5
SCHEMBL16257543 0.79 CCR2 (0.74) CCR2EGFRKCNH2CCR5

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 1/4885CNR2 21/4885EGFR 3193/4885

“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.