SCHEMBL4903225

SCHEMBL4903225

FC(F)(F)c1nccc(-c2cc[nH]n2)n1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 5/20 0.41
IDH2 P48735 4/20 0.41
MALT1 Q9UDY8 1/20 0.38
AAK1 Q2M2I8 3/20 0.36
TAS2R14 Q9NYV8 1/20 0.34
TGFBR1 P36897 1/20 0.31
IDO1 P14902 1/20 0.30

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
SCHEMBL1671095 0.74 GABRA1 (0.34) AAK1
SCHEMBL16784615 0.73 HSP90AA1 (0.48) TGFBR1
SCHEMBL31512367 0.72 MALT1 (0.49) MALT1TAS2R14
SCHEMBL16691672 0.71 KDM4E (0.55) IDH1IDH2
SCHEMBL30936047 0.71 IDH1 (0.39) IDH1IDH2TAS2R14IDO1
SCHEMBL4894244 0.71 IDH1 (0.38) IDH1IDH2MALT1AAK1TAS2R14
SCHEMBL19806512 0.70 NOTUM (0.45) IDH1IDH2
SCHEMBL1673128 0.69
SCHEMBL28886728 0.69 AURKA (0.53) IDH1IDH2MALT1AAK1
SCHEMBL26128744 0.69 IDO1 (0.33) IDO1

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
EP-4594309-A1 AZOLE MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION Genentech Inc. (US) 2025-08-06 EP disclosed
WO-2024073662-A1 AZOLE MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION GENENTECH, INC. (US) 2024-04-04 WO disclosed
US-20080171755-A1 Pyrimidinylpyrazoles as Tgf-Beta Inhibitors LEE WEN-CHERNG 2008-07-17 US disclosed
EP-1786803-A1 PYRIMIDINYLPYRAZOLES AS TGF-BETA INHIBITORS Biogen Idec MA, Inc. (US) 2007-05-23 EP disclosed
WO-2006026305-A1 PYRIMIDINYLPYRAZOLES AS TGF-BETA INHIBITORS BIOGEN IDEC MA INC (US) 2006-03-09 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-20080171755-A1 Pyrimidinylpyrazoles as Tgf-Beta Inhibitors TGFBR1, SMAD3, ALK IDH1 768/4885IDH2 2029/4885MALT1 1488/4885

“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.