SCHEMBL4833357

SCHEMBL4833357

OCC(CO)Nc1cc(Oc2ccc(F)cc2F)nc2[nH]nc(-c3ccccc3Cl)c12

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.36
TRPA1 O75762 1/20 0.33
CTSA P10619 3/20 0.33
SCN9A Q15858 1/20 0.33
DGAT2 Q96PD7 2/20 0.33
AXL P30530 2/20 0.32
TYRO3 Q06418 2/20 0.32
MERTK Q12866 2/20 0.32
MET P08581 1/20 0.32
MAPK11 Q15759 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32
NTRK1 P04629 1/20 0.31

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
SCHEMBL4021724 0.89 MAPK14 (0.39) MAPK14SCN9AAXLTYRO3MERTK
SCHEMBL4018020 0.88 MAPK14 (0.39) MAPK14TRPA1SCN9AAXLTYRO3
SCHEMBL4015293 0.84 MAPK14 (0.35) MAPK14TRPA1CTSAAXLTYRO3
SCHEMBL4015286 0.84 MAPK14 (0.35) MAPK14TRPA1CTSAAXLTYRO3
SCHEMBL4832594 0.84 MAPK14 (0.42) MAPK14TRPA1CTSAAXLTYRO3
SCHEMBL4842334 0.83 MAPK14 (0.38) MAPK14TRPA1CTSALPAR2
SCHEMBL4840856 0.78 MAPK14 (0.45) MAPK14AXLTYRO3MERTKMET
SCHEMBL4840546 0.78 MAPK14 (0.41) MAPK14AXLTYRO3MERTKMAPK11
SCHEMBL14018785 0.78 MAPK14 (0.45) MAPK14AXLTYRO3MERTKMET
SCHEMBL4842528 0.77 ALDH1A1 (0.42) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7435731-B2 Substituted pyrazolo[3,4-d]pyrimadines and methods of using the same ROCHE PALO ALTO LLC (US) 2008-10-14 US disclosed
US-7435731-B2 Substituted pyrazolo[3,4-d]pyrimadines and methods of using the same ROCHE PALO ALTO LLC (US) 2008-10-14 US disclosed
US-7435731-B2 Substituted pyrazolo[3,4-d]pyrimadines and methods of using the same ROCHE PALO ALTO LLC (US) 2008-10-14 US disclosed
US-20050197340-A1 Fused-pyrazolo pyrimidine and pyrazolo pyrimidinone derivatives and methods for using the same ROCHE PALO ALTO LLC 2005-09-08 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-20050197340-A1 Fused-pyrazolo pyrimidine and pyrazolo pyrimidinone derivatives and methods for using the same MAP3K1, MAPK1, MAP3K8 MAPK14 70/4885TRPA1 2797/4885CTSA 4492/4885

“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.