SCHEMBL4709268

SCHEMBL4709268

COc1ccc(C(OC(C)=O)C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.52
ALDH1A1 P00352 2/20 0.49
CYP3A4 P08684 1/20 0.49
MAPT P10636 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
POLB P06746 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
LDHA P00338 1/20 0.47
AKR1C3 P42330 4/20 0.46
AKR1C2 P52895 4/20 0.46
PTGS2 P35354 3/20 0.46
PTGS1 P23219 2/20 0.46
CYP1A2 P05177 2/20 0.46
CDC42 P60953 1/20 0.46
RAC1 P63000 1/20 0.46
TSHR P16473 1/20 0.46
SLC22A6 Q4U2R8 1/20 0.46
CA1 P00915 1/20 0.46

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
SCHEMBL8069881 0.86 LMNA (0.50) MAPK1ALDH1A1CYP3A4MAPTPOLB
SCHEMBL28803341 0.83 MAPT (0.49) MAPK1ALDH1A1CYP3A4MAPTNPC1
SCHEMBL17295989 0.83 LDHA (0.52) ALDH1A1MAPTNPC1RAB9APOLB
SCHEMBL3829660 0.83 LDHA (0.52) ALDH1A1MAPTNPC1RAB9APOLB
SCHEMBL17295985 0.83 LDHA (0.52) ALDH1A1MAPTNPC1RAB9APOLB
SCHEMBL31359577 0.83 MAPT (0.64) MAPK1ALDH1A1CYP3A4MAPTNPC1
SCHEMBL9768743 0.81 MEN1 (0.50) ALDH1A1MAPTNPC1RAB9APOLB
SCHEMBL8069856 0.81 ALDH1A1 (0.51) MAPK1ALDH1A1CYP3A4RAB9APOLB
SCHEMBL8068274 0.81 CYP3A4 (0.51) ALDH1A1CYP3A4MAPTMEN1KMT2A
SCHEMBL8475294 0.81 KLK7 (0.48) ALDH1A1MAPTNPC1RAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1660504-B1 THIENOPYRIDINE-PHENYLACET AMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER (US) 2008-10-29 EP disclosed
EP-1660504-B1 THIENOPYRIDINE-PHENYLACET AMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER (US) 2008-10-29 EP disclosed
US-7208500-B2 Thienopyridine-phenylacetamides and their derivatives useful as new anti-angiogenic agents AGOURON PHARMACEUTICALS, INC. (US) 2007-04-24 US disclosed
US-7208500-B2 Thienopyridine-phenylacetamides and their derivatives useful as new anti-angiogenic agents AGOURON PHARMACEUTICALS, INC. (US) 2007-04-24 US disclosed
US-7208500-B2 Thienopyridine-phenylacetamides and their derivatives useful as new anti-angiogenic agents AGOURON PHARMACEUTICALS, INC. (US) 2007-04-24 US disclosed
EP-1660504-A1 THIENOPYRIDINE-PHENYLACET AMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER INC. (US) 2006-05-31 EP disclosed
US-20050090509-A1 Thienopyridine-phenylacetamides and their derivatives useful as new anti-angiogenic agents Agouron Pharmaceuticals,Inc. 2005-04-28 US disclosed
WO-2005021554-A1 THIENOPYRIDINE-PHENYLACET AMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER INC. (US) 2005-03-10 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-20050090509-A1 Thienopyridine-phenylacetamides and their derivatives useful as new anti-angiogenic agents CCNA1, PGF, CCNA2 MAPK1 843/4885ALDH1A1 537/4885CYP3A4 741/4885

“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.