SCHEMBL1506163

SCHEMBL1506163

CCNC(=O)Cc1cc(Nc2cccc(C(F)(F)F)c2)nn1-c1ccnc(C)c1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.45
▸ LMNA P02545 2/20 0.44
▸ RECQL P46063 1/20 0.44
▸ AURKA O14965 12/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ TRPV1 Q8NER1 1/20 0.40
▸ PHGDH O43175 2/20 0.40
▸ GPR52 Q9Y2T5 1/20 0.39
▸ POLB P06746 1/20 0.39

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
SCHEMBL1506250 0.91 THRB (0.47) THRBLMNARECQLAURKAMAPK1
SCHEMBL1506069 0.89 CNR2 (0.44) THRBLMNARECQLAURKAMAPK1
SCHEMBL1506291 0.87 THRB (0.47) THRBLMNARECQLAURKAMAPK1
SCHEMBL1506231 0.87 MAPK1 (0.45) MAPK1GPR52
SCHEMBL10011105 0.86 GSK3B (0.40) MAPK1
SCHEMBL1506314 0.85 THRB (0.52) THRBLMNARECQLAURKAPHGDH
SCHEMBL1506298 0.84 THRB (0.47) THRBLMNARECQLAURKAMAPK1
SCHEMBL1506157 0.83 P2RX7 (0.41) MAPK1TRPV1
SCHEMBL1506093 0.83 THRB (0.46) THRBLMNARECQLAURKAMAPK1
Isophthalic Acid SCHEMBL27864979 0.83 AURKA (0.51) THRBLMNARECQLAURKAMAPK1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102574832-B Substituted N-phenyl-1-(4-pyridinyl)-1H-pyrazol-3-amines JANSSEN PHARMACEUTICA NV 2014-09-24 — — CN disclosed
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
EP-2491024-A1 SUBSTITUTED N-PHENYL-1-(4-PYRIDINYL)-1H-PYRAZOL-3-AMINES Janssen Pharmaceutica N.V. (BE) 2012-08-29 — — EP disclosed
CN-102574832-A Substituted N-phenyl-1-(4-pyridinyl)-1H-pyrazol-3-amines JANSSEN PHARMACEUTICA NV 2012-07-11 — — CN disclosed
US-20120172354-A1 Substituted N-Phenyl-1-(4-Pyridinyl)-1H-Pyrazol-3-Amines JANSSEN PHARMACEUTICA NV (BE) 2012-07-05 — — US disclosed
WO-2011033018-A1 SUBSTITUTED N-PHENYL-1-(4-PYRIDINYL)-1H-PYRAZOL-3-AMINES JANSSEN PHARMACEUTICA NV (BE) 2011-03-24 — — 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-20120172354-A1 Substituted N-Phenyl-1-(4-Pyridinyl)-1H-Pyrazol-3-Amines CHRM1, CHRNA1, CHRM3 THRB 226/4885LMNA 3892/4885RECQL 1210/4885

“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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