SCHEMBL5695754

SCHEMBL5695754

Cc1cccc(-c2sc(N)nc2-c2ccc3ncoc3c2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 14/20 0.59
MAPK14 Q16539 1/20 0.59
DYRK1A Q13627 1/20 0.45
MAPT P10636 3/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
MAPK1 P28482 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 2/20 0.39
XBP1 P17861 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MTOR P42345 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL4033864 0.81 TGFBR1 (0.82) TGFBR1MAPK14MAPTALDH1A1LMNA
SCHEMBL4031845 0.80 TGFBR1 (0.68) TGFBR1MAPK14DYRK1A
SCHEMBL4033122 0.77 TGFBR1 (0.58) TGFBR1MAPK14MAPTALDH1A1LMNA
SCHEMBL5695774 0.77 TGFBR1 (0.55) TGFBR1MAPK14DYRK1AMAPTALDH1A1
SCHEMBL25366177 0.76 DYRK1A (0.43) TGFBR1MAPK14DYRK1AMAPTALDH1A1
SCHEMBL30520086 0.76 DYRK1A (0.43) TGFBR1MAPK14DYRK1AMAPTALDH1A1
SCHEMBL4032677 0.75 TGFBR1 (0.54) TGFBR1MAPK14MAPTALDH1A1LMNA
SCHEMBL5656833 0.75 TGFBR1 (0.53) TGFBR1MAPK14MAPTALDH1A1LMNA
SCHEMBL4035145 0.74 TGFBR1 (1.00) TGFBR1MAPK14MTOR
SCHEMBL4032214 0.74 TGFBR1 (1.00) TGFBR1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006527720-A 2006-12-07 JP claimed
US-20060247233-A1 Thiazoles inhibitors of the alk-5 receptor SMITHKLINE BEECHAM CORPORATION 2006-11-02 US claimed
EP-1660494-A2 THIAZOLES AS INHIBITORS OF THE ALK-5 RECEPTOR SMITHKLINE BEECHAM CORPORATION (US) 2006-05-31 EP claimed
WO-2004111046-A2 THIAZOLES AS INHIBITORS OF THE ALK- 5 RECEPTOR SMITHKLINE BEECHAM CORPORATION (US) 2004-12-23 WO claimed
US-20060247233-A1 Thiazoles inhibitors of the alk-5 receptor SMITHKLINE BEECHAM CORPORATION 2006-11-02 US disclosed
EP-1660494-A2 THIAZOLES AS INHIBITORS OF THE ALK-5 RECEPTOR SMITHKLINE BEECHAM CORPORATION (US) 2006-05-31 EP disclosed
WO-2004111046-A2 THIAZOLES AS INHIBITORS OF THE ALK- 5 RECEPTOR SMITHKLINE BEECHAM CORPORATION (US) 2004-12-23 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-20060247233-A1 Thiazoles inhibitors of the alk-5 receptor SMAD3, ALK, SMAD2 TGFBR1 4/4885MAPK14 386/4885DYRK1A 459/4885

“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.