SCHEMBL902664

SCHEMBL902664

Oc1c(Cc2cc(F)cc(C(F)(F)F)c2)c(C2CCC2)nc2ccnn12

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.38
CETP P11597 2/20 0.36
KCNN3 Q9UGI6 1/20 0.35
CCR2 P41597 1/20 0.35
GPR52 Q9Y2T5 12/20 0.34
ADORA2A P29274 1/20 0.33
CHEK1 O14757 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCNA1 P78396 1/20 0.31

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
SCHEMBL902639 0.96 CCR2 (0.38) PDE2ACETPKCNN3CCR2GPR52
SCHEMBL902561 0.86 CCR2 (0.37) KCNN3CCR2CHEK1CCNA2CDK2
SCHEMBL901602 0.85 CETP (0.42) CETPKCNN3CCR2
SCHEMBL902442 0.84 CHEK1 (0.34) PDE2ACCR2CHEK1CCNA2CDK2
SCHEMBL902701 0.84 CCR2 (0.50) KCNN3CCR2
SCHEMBL902376 0.83 PDE2A (0.39) PDE2ACETPGPR52
SCHEMBL15274714 0.81 PDE2A (0.35) PDE2AKCNN3CCR2CCNA2CDK2
SCHEMBL902644 0.81 PDE2A (0.35) PDE2ACETPCCR2CHEK1CCNA2
SCHEMBL902108 0.80 CCR2 (0.34) KCNN3CCR2CHEK1CCNA2CDK2
SCHEMBL902332 0.79 KCNN3 (0.39) KCNN3GPR52

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130252951-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS PROXIMAGEN LIMITED (GB) 2013-09-26 US disclosed
US-20130252951-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS PROXIMAGEN LIMITED (GB) 2013-09-26 US disclosed
EP-2621928-A1 7-HYDROXY-PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS Proximagen Limited (GB) 2013-08-07 EP disclosed
WO-2012041817-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2012-04-05 WO 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-20130252951-A1 7-HYDROXY-PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND THEIR USE AS CCR2 RECEPTOR ANTAGONISTS CCR2, CCR5, CCR1 PDE2A 2387/4885CETP 3753/4885KCNN3 4658/4885

“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.