SCHEMBL4479724

SCHEMBL4479724

CC(O)CNc1nc(Oc2ccc(F)cc2F)nc2c1c(-c1ccccc1Cl)nn2COC(=O)CCC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 4/20 0.37
FABP7 O15540 1/20 0.37
FABP5 Q01469 1/20 0.37
CTSA P10619 9/20 0.34
CREBBP Q92793 1/20 0.32
DGAT2 Q96PD7 1/20 0.32
FFAR1 O14842 1/20 0.31
SNCA P37840 1/20 0.31
MET P08581 2/20 0.31
AXL P30530 2/20 0.31
TYRO3 Q06418 2/20 0.31
MERTK Q12866 2/20 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
SCHEMBL4480138 1.00 FABP3 (0.37) FABP3FABP7FABP5CTSACREBBP
SCHEMBL4755290 0.97 FABP3 (0.36) FABP3FABP7FABP5CTSACREBBP
SCHEMBL4475490 0.90 MAPK14 (0.38) FABP3FABP7FABP5CTSADGAT2
SCHEMBL4475438 0.88 MAPK14 (0.41) FABP3FABP7FABP5CTSADGAT2
SCHEMBL4480988 0.87 PDE10A (0.34) CTSADGAT2METAXLTYRO3
SCHEMBL13672547 0.87 PDE10A (0.34) CTSADGAT2METAXLTYRO3
SCHEMBL13672548 0.87 DGAT2 (0.33) FABP3FABP7FABP5CTSACREBBP
SCHEMBL4474346 0.87 DGAT2 (0.33) FABP3FABP7FABP5CTSACREBBP
SCHEMBL13672572 0.85 DGAT1 (0.34) FABP3FABP7FABP5DGAT2MET
SCHEMBL4472386 0.80 FABP3 (0.41) FABP3FABP7FABP5CTSADGAT2

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-7608603-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 MAP kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-10-27 US claimed
US-7608603-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 MAP kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-10-27 US disclosed
EP-1919914-A2 P38 MAP KINASE INHIBITORS AND METHODS FOR USING THE SAME F.HOFFMANN-LA ROCHE AG (CH) 2008-05-14 EP disclosed
US-20070049597-A1 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2007-03-01 US disclosed
WO-2007023115-A2 P38 MAP KINASE INHIBITORS AND METHODS FOR USING THE SAME F. HOFFMANN-LA ROCHE AG (CH) 2007-03-01 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-20070049597-A1 p38 MAP kinase inhibitors and methods for using the same MAPK1, MAPK9, MAPK3 FABP3 3757/4885FABP7 3804/4885FABP5 4575/4885

“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.