SCHEMBL10008965

SCHEMBL10008965

Cc1cc(-n2nc(Nc3ccc(F)c(F)c3)cc2COCc2ccccc2)ccn1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 10/20 0.42
▸ GSK3B P49841 3/20 0.38
▸ KCNJ6 P48051 2/20 0.37
▸ KCNJ5 P48544 2/20 0.37
▸ KCNJ3 P48549 2/20 0.37
▸ MAPT P10636 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ TDO2 P48775 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ ERBB2 P04626 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ PABPC1 P11940 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ABCB1 P08183 1/20 0.33
▸ ABCC1 P33527 1/20 0.33
▸ ABCG2 Q9UNQ0 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
SCHEMBL10008684 0.91 MAPK1 (0.44) MAPK1GSK3BKCNJ6KCNJ5KCNJ3
SCHEMBL1506106 0.86 MAPK1 (0.36) MAPK1GSK3BKCNJ6KCNJ5KCNJ3
SCHEMBL10009026 0.84 MAPK1 (0.41) MAPK1MAPT
SCHEMBL10008700 0.84 SLC2A1 (0.46) MAPK1GSK3BMAPTKMT2A
SCHEMBL10008625 0.81 MAPK1 (0.39) MAPK1MAPTKDM4EEGFR
SCHEMBL1506198 0.81 MAPK1 (0.38) MAPK1GSK3BKCNJ6KCNJ5KCNJ3
SCHEMBL10009006 0.80 RIPK1 (0.42) MAPK1EGFR
SCHEMBL1506262 0.80 KCNJ6 (0.41) MAPK1GSK3BKCNJ6KCNJ5KCNJ3
SCHEMBL10010076 0.79 KDR (0.44) MAPK1GSK3BMAPTKDM4E
SCHEMBL1506218 0.79 KCNJ6 (0.40) 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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