SCHEMBL10124754

SCHEMBL10124754

Cc1cnc(Nc2ccccc2N)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 1/20 0.50
MAPT P10636 5/20 0.47
GAA P10253 5/20 0.47
TDP1 Q9NUW8 2/20 0.47
KDM4E B2RXH2 4/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
PIK3CA P42336 1/20 0.43
PRKDC P78527 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
STAT1 P42224 1/20 0.42
TP53 P04637 1/20 0.42
APP P05067 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL17107923 0.82 MAPK10 (0.53) MAPK10MAPTGAALMNAPIK3CA
SCHEMBL10124732 0.82 MAPK10 (0.53) MAPK10MAPTGAATDP1KDM4E
SCHEMBL13562420 0.77 MAPT (0.60) MAPK10MAPTGAAKDM4EMEN1
SCHEMBL12589886 0.76 TSHR (0.43) MAPTGAAMEN1KMT2AALOX15
SCHEMBL29581680 0.76 MAPT (0.61) MAPK10MAPTGAATDP1KDM4E
SCHEMBL29581691 0.75 UHRF1 (0.48) MAPK10MAPTGAATDP1KDM4E
SCHEMBL18434189 0.74 PDGFRB (0.53) MAPK10MAPTTDP1KDM4EMEN1
SCHEMBL2779777 0.74 MEN1 (0.50) MAPK10MAPTGAATDP1KDM4E
SCHEMBL10124752 0.73 MAPT (0.53) MAPTGAATDP1KDM4EMEN1
SCHEMBL3847392 0.72 MAPK10 (0.50) MAPK10MAPTGAAKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324219-B2 Substituted benzoimidazolyl-pyrazine compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-12-04 US disclosed
US-20120190853-A1 BENZOIMIDAZOLYL-PYRAZINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2012-07-26 US disclosed
US-8119643-B2 Benzoimidazolyl-pyrazine compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-02-21 US disclosed
US-20100273751-A1 SUBSTITUTED BENZOIMIDAZOLYL-PYRAZINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2010-10-28 US disclosed
US-20070249609-A1 Benzoimidazolyl-pyrazine compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. 2007-10-25 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 (3 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-20120190853-A1 BENZOIMIDAZOLYL-PYRAZINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES IL5, CXCR5, NLRP3 MAPK10 3876/4885MAPT 2658/4885GAA 1516/4885
US-20100273751-A1 SUBSTITUTED BENZOIMIDAZOLYL-PYRAZINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES NLRP3, IL5, NLRP1 MAPK10 3289/4885MAPT 1109/4885GAA 1235/4885
US-20070249609-A1 Benzoimidazolyl-pyrazine compounds for inflammation and immune-related uses IL5, CXCR5, NLRP3 MAPK10 3876/4885MAPT 2658/4885GAA 1516/4885

“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.