SCHEMBL902816

SCHEMBL902816

Oc1c(Cc2ccc(Cl)c(Cl)c2)c(C(F)(F)F)nc2ccnn12

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNN3 Q9UGI6 4/20 0.36
CNR2 P34972 3/20 0.34
CNR1 P21554 1/20 0.34
PDE10A Q9Y233 1/20 0.34
CCR2 P41597 3/20 0.32
TTR P02766 1/20 0.32
RNASEH1 O60930 1/20 0.32
KCNN1 Q92952 1/20 0.32
KCNN2 Q9H2S1 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MBOAT4 Q96T53 2/20 0.31
PTPN5 P54829 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
SCHEMBL15274725 0.82 HTT (0.37) KCNN3PDE10ACCR2RNASEH1KCNN1
SCHEMBL901640 0.81 PRKAB2 (0.36) KCNN3CNR2CNR1PDE10ACCR2
SCHEMBL902482 0.81 PDE10A (0.33) KCNN3PDE10ACCR2RNASEH1KCNN1
SCHEMBL902335 0.80 PRKAB2 (0.38) KCNN3PDE10ACCR2RNASEH1KCNN1
SCHEMBL901553 0.79 CCR2 (0.46) KCNN3PDE10ACCR2RNASEH1KCNN1
SCHEMBL902587 0.79 RNASEH1 (0.46) KCNN3PDE10ACCR2RNASEH1KCNN1
SCHEMBL901430 0.78 CCR2 (0.47) KCNN3PDE10ACCR2RNASEH1KCNN1
SCHEMBL901506 0.78 RNASEH1 (0.38) PDE10ACCR2RNASEH1TSHR
SCHEMBL902398 0.77 PRKAB2 (0.34) KCNN3CNR2PDE10ACCR2TSHR
SCHEMBL901794 0.76 RNASEH1 (0.37) KCNN3CCR2RNASEH1KCNN1KCNN2

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 KCNN3 4658/4885CNR2 97/4885CNR1 62/4885

“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.