SCHEMBL15569152

SCHEMBL15569152

NC(=O)C(Nc1cncc(-c2cc(Cl)c(F)cc2F)c1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 3/20 0.44
SLC22A12 Q96S37 3/20 0.44
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
PDGFRA P16234 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPKAPK2 P49137 1/20 0.39
RPS6KA1 Q15418 1/20 0.39
AURKB Q96GD4 1/20 0.39
CSNK1G1 Q9HCP0 1/20 0.39
CNR1 P21554 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
HTT P42858 1/20 0.38
FDPS P14324 1/20 0.38
DCAF1 Q9Y4B6 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL15569129 0.89 CNR1 (0.46) XDHSLC22A12CYP3A4CYP2C9PDGFRA
SCHEMBL15569128 0.89 CNR1 (0.46) XDHSLC22A12CYP3A4CYP2C9PDGFRA
SCHEMBL15569878 0.86 XDH (0.54) XDHSLC22A12CYP3A4CYP2C9PDGFRA
SCHEMBL15569443 0.82 MDM2 (0.44) XDHSLC22A12CNR1MDM2
SCHEMBL15570006 0.82 SYK (0.44) XDHSLC22A12CYP2C9PDGFRAMAPK1
SCHEMBL15569177 0.81 CTSA (0.49) XDHSLC22A12CYP3A4CYP2C9PDGFRA
SCHEMBL15569877 0.81 CNR1 (0.47) XDHSLC22A12CYP3A4CYP2C9PDGFRA
SCHEMBL15569781 0.80 CNR1 (0.47) XDHSLC22A12CNR1MEN1KMT2A
SCHEMBL15569783 0.80 CNR1 (0.47) XDHSLC22A12CNR1MEN1KMT2A
SCHEMBL15570216 0.80 SYK (0.44) XDHSLC22A12CYP3A4CYP2C9PDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9458106-B2 Phenyl-pyridine/pyrazine amides for the treatment of cancer HOFFMANN-LA ROCHE INC. (US) 2016-10-04 US claimed
EP-2888232-A1 NOVEL PHENYL-PYRIDINE/PYRAZINE AMIDES FOR THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2015-07-01 EP claimed
US-20150158815-A1 NOVEL PHENYL-PYRIDINE/PYRAZINE AMIDES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2015-06-11 US claimed
WO-2014029726-A1 NOVEL PHENYL-PYRIDINE/PYRAZINE AMIDES FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2014-02-27 WO claimed
US-9458106-B2 Phenyl-pyridine/pyrazine amides for the treatment of cancer HOFFMANN-LA ROCHE INC. (US) 2016-10-04 US disclosed
US-9458106-B2 Phenyl-pyridine/pyrazine amides for the treatment of cancer HOFFMANN-LA ROCHE INC. (US) 2016-10-04 US disclosed
EP-2888232-A1 NOVEL PHENYL-PYRIDINE/PYRAZINE AMIDES FOR THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2015-07-01 EP disclosed
US-20150158815-A1 NOVEL PHENYL-PYRIDINE/PYRAZINE AMIDES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2015-06-11 US disclosed
US-20150158815-A1 NOVEL PHENYL-PYRIDINE/PYRAZINE AMIDES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2015-06-11 US disclosed
CN-104619686-A Novel phenyl-pyridine/pyrazine amides for the treatment of cancer HOFFMANN LA ROCHE 2015-05-13 CN disclosed
WO-2014029726-A1 NOVEL PHENYL-PYRIDINE/PYRAZINE AMIDES FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2014-02-27 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-20150158815-A1 NOVEL PHENYL-PYRIDINE/PYRAZINE AMIDES FOR THE TREATMENT OF CANCER TP53, RB1, HCCS XDH 1992/4885SLC22A12 1361/4885CYP3A4 814/4885

“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.