SCHEMBL5032527

SCHEMBL5032527

COc1ccc(N(C(=O)c2ccc(Cl)cc2Cl)c2nc(C(=O)O)cs2)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
TTR P02766 1/20 0.39
TSHR P16473 2/20 0.39
CYP3A4 P08684 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 1/20 0.37
CRHBP P24387 2/20 0.37
CRHR2 Q13324 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CASP1 P29466 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PYGL P06737 1/20 0.36
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL5035149 0.95 ALDH1A1 (0.41) ALDH1A1FLT1FLT4KDRTTR
SCHEMBL5041155 0.94 CYP3A4 (0.39) ALDH1A1TTRTSHRCYP3A4MRGPRX4
SCHEMBL5032622 0.92 FLT1 (0.40) ALDH1A1FLT1FLT4KDRTTR
SCHEMBL5035778 0.90 RAB9A (0.46) FLT1FLT4KDRTSHRCYP3A4
SCHEMBL5034722 0.90 CYP3A4 (0.44) ALDH1A1FLT1FLT4KDRTSHR
SCHEMBL5032643 0.90 FLT1 (0.38) ALDH1A1FLT1FLT4KDRTTR
SCHEMBL5032563 0.89 ALDH1A1 (0.47) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL6491942 0.89 TSHR (0.42) ALDH1A1TSHRCRHBPCRHR2MEN1
SCHEMBL5039048 0.88 CYP3A4 (0.43) ALDH1A1FLT1FLT4KDRTSHR
SCHEMBL5035872 0.88 LMNA (0.48) TSHRCYP3A4MAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371751-B2 Thiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US claimed
EP-1694673-B1 THIAZOLE DERIVATES HOFFMANN LA ROCHE (CH) 2008-01-16 EP claimed
JP-2007513193-A 2007-05-24 JP claimed
EP-1694673-A1 NOVEL THIAZOLE DERIVATES F.HOFFMANN-LA ROCHE AG (CH) 2006-08-30 EP claimed
US-20050153962-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 US claimed
WO-2005058887-A1 NOVEL THIAZOLE DERIVATES F. HOFFMANN-LA ROCHE AG (CH) 2005-06-30 WO claimed
US-7371751-B2 Thiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US disclosed
EP-1694673-B1 THIAZOLE DERIVATES HOFFMANN LA ROCHE (CH) 2008-01-16 EP disclosed
EP-1694673-A1 NOVEL THIAZOLE DERIVATES F.HOFFMANN-LA ROCHE AG (CH) 2006-08-30 EP disclosed
US-20050153962-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 US disclosed
WO-2005058887-A1 NOVEL THIAZOLE DERIVATES F. HOFFMANN-LA ROCHE AG (CH) 2005-06-30 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-20050153962-A1 Thiazole derivatives CNR1, CNR2, GPR119 ALDH1A1 473/4885FLT1 1346/4885FLT4 1463/4885

“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.