SCHEMBL15569787

SCHEMBL15569787

NC(=O)C(Nc1cncc(Br)c1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.51
CYP2C9 P11712 3/20 0.48
CYP3A4 P08684 2/20 0.48
PDGFRA P16234 2/20 0.48
MAPK1 P28482 2/20 0.48
MAPKAPK2 P49137 2/20 0.48
RPS6KA1 Q15418 2/20 0.48
AURKB Q96GD4 2/20 0.48
CSNK1G1 Q9HCP0 2/20 0.48
CSF1R P07333 1/20 0.45
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
KCNH2 Q12809 1/20 0.43
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.43
HDAC4 P56524 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL15798219 1.00 SYK (0.51) SYKCYP2C9CYP3A4PDGFRAMAPK1
SCHEMBL16766182 0.89 FPR2 (0.47) SYKCYP2C9CYP3A4CSF1RCYP1A2
SCHEMBL15569167 0.89 FPR2 (0.47) SYKCYP2C9CYP3A4CSF1RCYP1A2
SCHEMBL15569149 0.86 SYK (0.47) SYKCSF1RHTTSMN1; SMN2MEN1
SCHEMBL15569879 0.86 EGFR (0.41) SYKCSF1RKMT2AEGFR
SCHEMBL15569778 0.86 SYK (0.48) SYKCYP2C9PDGFRAMAPK1MAPKAPK2
SCHEMBL15569968 0.86 CSF1R (0.51) SYKCYP2C9CYP3A4PDGFRAMAPK1
SCHEMBL15569806 0.84 L3MBTL1 (0.47) SYKCYP2C9CYP3A4CSF1RCYP1A2
SCHEMBL15569635 0.82 KMT2A (0.40) SYKCYP2C9CYP3A4PDGFRAMAPK1
SCHEMBL15569627 0.82 HDAC4 (0.41) SYKCSF1RALOX15HTTHDAC4

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 disclosed
US-9458106-B2 Phenyl-pyridine/pyrazine amides for the treatment of cancer HOFFMANN-LA ROCHE INC. (US) 2016-10-04 US disclosed
EP-2928893-A1 NOVEL BI-RING PHENYL-PYRIDINES/PYRAZINES FOR THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2015-10-14 EP disclosed
US-20150266878-A1 NOVEL BI-RING PHENYL-PYRIDINES/PYRAZINES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2015-09-24 US disclosed
US-20150266878-A1 NOVEL BI-RING PHENYL-PYRIDINES/PYRAZINES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2015-09-24 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
WO-2014090692-A1 NOVEL BI-RING PHENYL-PYRIDINES/PYRAZINES FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2014-06-19 WO disclosed
WO-2014090692-A1 NOVEL BI-RING PHENYL-PYRIDINES/PYRAZINES FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2014-06-19 WO 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 (2 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 SYK 3149/4885CYP2C9 1919/4885CYP3A4 814/4885
US-20150266878-A1 NOVEL BI-RING PHENYL-PYRIDINES/PYRAZINES FOR THE TREATMENT OF CANCER RB1, TP53, BRD4 SYK 2591/4885CYP2C9 1378/4885CYP3A4 415/4885

“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.