SCHEMBL70140

SCHEMBL70140

CCCSc1cc(O)cc(O)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
PTGS2 P35354 4/20 0.40
CYP3A4 P08684 1/20 0.40
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 0.38
CA13 Q8N1Q1 1/20 0.38
BACE1 P56817 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
AR P10275 2/20 0.36
ACHE P22303 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
APLNR P35414 2/20 0.33
PTGS1 P23219 2/20 0.33
KMT2A Q03164 1/20 0.32

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
SCHEMBL68666 0.86 PTGS2 (0.47) PTGS2CYP3A4MAOAMAOBAR
SCHEMBL10693117 0.82 MAPT (0.47) MAPTCA12CA1CA2CA7
SCHEMBL69901 0.80 BACE1 (0.42) PTGS2CYP3A4CA12CA1CA2
SCHEMBL11157064 0.78 BACE1 (0.40) PTGS2BACE1ACHEKMT2A
SCHEMBL10885339 0.77 MAPT (0.39) MAPTPTGS2CA12CA1CA2
SCHEMBL3720925 0.76 CA2 (0.52) MAPTPTGS2CYP3A4CA12CA1
Resorcinol SCHEMBL27639382 0.76 ALDH1A1 (0.50) MAPTCYP3A4CA12CA1CA2
SCHEMBL19132550 0.75 MAPT (0.43) MAPTPTGS2CA12CA1CA2
SCHEMBL11590492 0.73 CYP3A4 (0.39) PTGS2CYP3A4CA12CA1CA2
SCHEMBL9154935 0.73 ALOX15 (0.57) MAPTPTGS2CYP3A4CA1CA2

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-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US 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-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 MAPT 1923/4885PTGS2 2866/4885CYP3A4 2028/4885

“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.