SCHEMBL2630725

SCHEMBL2630725

FC(F)(F)c1cc2[nH]ncc2c(Cl)n1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 12/20 0.41
▸ AXL P30530 1/20 0.41
▸ CYP1A2 P05177 8/20 0.41
▸ TRPA1 O75762 2/20 0.38
▸ TRPM8 Q7Z2W7 1/20 0.38
▸ TRPV1 Q8NER1 1/20 0.38
▸ NOS1 P29475 3/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ IDO1 P14902 1/20 0.36
▸ TDO2 P48775 1/20 0.36
▸ PTPN6 P29350 1/20 0.36

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
SCHEMBL16522812 0.76 NOS1 (0.42) METAP2AXLNOS1DYRK1AIDO1
SCHEMBL30852842 0.76 NOS1 (0.42) METAP2AXLNOS1DYRK1AIDO1
SCHEMBL35211500 0.74 METAP2 (0.39) METAP2TRPA1TRPM8TRPV1NOS1
SCHEMBL2630775 0.73 IDO1 (0.44) METAP2NOS1DYRK1AIDO1TDO2
SCHEMBL17518917 0.69 METAP2 (0.53) METAP2TRPA1TRPM8TRPV1NOS1
SCHEMBL30959600 0.68 AXL (0.47) METAP2AXLCYP1A2TRPA1TRPM8
SCHEMBL2630729 0.67 NT5E (0.30) —
SCHEMBL30997139 0.67 AXL (0.46) METAP2AXLCYP1A2TRPA1TRPM8
SCHEMBL10850431 0.67 NT5E (0.42) METAP2TRPA1TRPM8TRPV1NOS1
SCHEMBL5660020 0.66 NT5E (0.41) —

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-20130267513-A1 PYRAZOLOPYRIDINES AS INHIBITORS OF THE KINASE LRRK2 MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2013-10-10 — — US disclosed
EP-2569293-A1 PYRAZOLOPYRIDINES AS INHIBITORS OF THE KINASE LRRK2 Medical Research Council Technology (GB) 2013-03-20 — — EP disclosed
WO-2011141756-A1 PYRAZOLOPYRIDINES AS INHIBITORS OF THE KINASE LRRK2 MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2011-11-17 — — 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-20130267513-A1 PYRAZOLOPYRIDINES AS INHIBITORS OF THE KINASE LRRK2 LRRK2, PARK7, GRK3 METAP2 4123/4885AXL 962/4885CYP1A2 3622/4885

“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.

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