SCHEMBL10008684

SCHEMBL10008684

Cc1cc(-n2nc(Nc3ccc(F)c(F)c3)cc2CCCOCc2ccccc2)ccn1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 14/20 0.44
▸ GSK3B P49841 1/20 0.36
▸ KCNJ6 P48051 2/20 0.35
▸ KCNJ5 P48544 2/20 0.35
▸ KCNJ3 P48549 2/20 0.35
▸ SLC34A1 Q06495 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 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
SCHEMBL10008965 0.91 MAPK1 (0.42) MAPK1GSK3BKCNJ6KCNJ5KCNJ3
SCHEMBL10009969 0.85 MAPK1 (0.43) MAPK1
SCHEMBL10010156 0.85 SLC2A1 (0.44) MAPK1GSK3BMAPT
SCHEMBL10009120 0.83 MAPK1 (0.40) MAPK1SLC34A1MAPT
SCHEMBL1506344 0.82 MAPK1 (0.36) MAPK1GSK3BKCNJ6KCNJ5KCNJ3
SCHEMBL10009645 0.82 MAPK1 (0.41) MAPK1SLC34A1
SCHEMBL10010435 0.81 KDR (0.41) MAPK1GSK3BKDM4EMAPT
SCHEMBL1506106 0.81 MAPK1 (0.36) MAPK1GSK3BKCNJ6KCNJ5KCNJ3
SCHEMBL10315974 0.79 MAPK1 (0.46) MAPK1MAPT
SCHEMBL1506198 0.79 MAPK1 (0.38) MAPK1GSK3BKCNJ6KCNJ5KCNJ3

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 MAPK1 1404/4885GSK3B 1943/4885KCNJ6 181/4885

“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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