SCHEMBL10009040

SCHEMBL10009040

CC[C@@H](O)Cc1cc(Nc2cc(F)cc(Cl)c2)nn1-c1ccnc(C)c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.36
▸ MAPK1 P28482 13/20 0.34
▸ RAPGEF4 Q8WZA2 1/20 0.33
▸ EPAS1 Q99814 2/20 0.33
▸ GRM4 Q14833 1/20 0.32
▸ IDH1 O75874 1/20 0.31
▸ JAK2 O60674 1/20 0.30
▸ JAK1 P23458 1/20 0.30

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
SCHEMBL10010193 0.88 P2RX7 (0.33) P2RX7MAPK1JAK2
SCHEMBL27981728 0.88 P2RX7 (0.33) P2RX7MAPK1JAK2
SCHEMBL10009201 0.88 P2RX7 (0.33) P2RX7MAPK1JAK2
SCHEMBL10010256 0.87 MAPK1 (0.41) MAPK1
SCHEMBL10009558 0.86 MAPK1 (0.34) P2RX7MAPK1
SCHEMBL10009796 0.86 MAPK1 (0.34) P2RX7MAPK1
SCHEMBL27982242 0.86 MAPK1 (0.34) P2RX7MAPK1
SCHEMBL10008635 0.85 MAPK1 (0.35) P2RX7MAPK1
SCHEMBL10009314 0.85 MAPK1 (0.35) P2RX7MAPK1
SCHEMBL27982244 0.85 MAPK1 (0.35) P2RX7MAPK1

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-8791144-B2 Substituted N-phenyl-1-(4-Pyridinyl)-1H-pyrazol-3-amines JANSSEN PHARMACEUTICA NV (BE) 2014-07-29 — — US disclosed
EP-2491024-B1 SUBSTITUTED N-PHENYL-1-(4-PYRIDINYL)-1H-PYRAZOL-3-AMINES JANSSEN PHARMACEUTICA NV (BE) 2013-11-20 — — EP disclosed
US-20120172354-A1 Substituted N-Phenyl-1-(4-Pyridinyl)-1H-Pyrazol-3-Amines JANSSEN PHARMACEUTICA NV (BE) 2012-07-05 — — 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-20120172354-A1 Substituted N-Phenyl-1-(4-Pyridinyl)-1H-Pyrazol-3-Amines CHRM1, CHRNA1, CHRM3 P2RX7 43/4885MAPK1 1404/4885RAPGEF4 465/4885

“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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