SCHEMBL902485

SCHEMBL902485

Oc1c(Cc2cccc(Cl)c2)c(C2=CC=C2)nc2ccnn12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN3 Q9UGI6 4/20 0.46
ENPP1 P22413 1/20 0.37
KCNN1 Q92952 1/20 0.36
KCNN2 Q9H2S1 1/20 0.36
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
ADCY10 Q96PN6 1/20 0.34
CCR2 P41597 6/20 0.34
RAD52 P43351 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
HTT P42858 1/20 0.33
CCR5 P51681 1/20 0.33
LMNA P02545 2/20 0.33
POLB P06746 1/20 0.33
PDE10A Q9Y233 1/20 0.33
USP2 O75604 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL902594 0.87 PDE10A (0.35) KCNN3ENPP1KCNN1KCNN2KDM4E
SCHEMBL902482 0.85 PDE10A (0.33) KCNN3KCNN1KCNN2CCR2CCR5
SCHEMBL901756 0.85 MAPKAPK2 (0.35) KCNN3KCNN1KCNN2PDE10A
SCHEMBL902646 0.83 KDM5A (0.31)
SCHEMBL902444 0.81
SCHEMBL902809 0.80 CCR2 (0.49) KCNN3ENPP1KCNN1KCNN2KDM4E
SCHEMBL902378 0.79 NR3C2 (0.34)
SCHEMBL902760 0.79 KCNN3 (0.46) KCNN3ENPP1KCNN1KCNN2KDM4E
SCHEMBL902483 0.78 CCR2 (0.47) KCNN3ENPP1KCNN1KCNN2KDM4E
SCHEMBL902665 0.77 GPR52 (0.36) KCNN3

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
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 4658/4885ENPP1 2434/4885KCNN1 4632/4885

“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.