SCHEMBL4837199

SCHEMBL4837199

CC(C)(C)OC(=O)CCNc1nc(Oc2ccc(F)cc2F)nc2[nH]nc(-c3ccccc3Cl)c12

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 1/20 0.42
MAPK14 Q16539 14/20 0.41
MAPK11 Q15759 1/20 0.35
PI4KA P42356 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
CCNT1 O60563 1/20 0.34
LPAR2 Q9HBW0 1/20 0.33
CTSA P10619 1/20 0.33
CNR1 P21554 1/20 0.32

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
SCHEMBL4843308 0.95 DGAT2 (0.40) DGAT2MAPK14MAPK11PI4KAPI4KB
SCHEMBL4844959 0.92 CCNT1 (0.39) DGAT2MAPK14MAPK11CCNT1LPAR2
SCHEMBL4837403 0.89 MAPK14 (0.42) MAPK14MAPK11LPAR2CTSA
SCHEMBL4833047 0.88 MAPK14 (0.41) MAPK14MAPK11LPAR2CTSA
SCHEMBL4842430 0.87 MAPK14 (0.41) MAPK14MAPK11CTSACNR1
SCHEMBL4841030 0.86 MAPK14 (0.41) MAPK14MAPK11LPAR2CTSA
SCHEMBL4013149 0.86 MAPK14 (0.40) MAPK14MAPK11CTSACNR1
SCHEMBL4845132 0.85 MAPK14 (0.41) MAPK14MAPK11LPAR2CTSA
SCHEMBL4017385 0.85 MAPK14 (0.41) MAPK14MAPK11LPAR2CTSA
SCHEMBL4841418 0.84 MAPK14 (0.41) MAPK14MAPK11LPAR2

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 claimed
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 DGAT2 4662/4885MAPK14 70/4885MAPK11 75/4885

“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.