SCHEMBL69902

SCHEMBL69902

CCc1cc(O)cc(S)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.40
CYP3A4 P08684 1/20 0.40
ACHE P22303 1/20 0.39
TRPA1 O75762 1/20 0.38
LTA4H P09960 1/20 0.38
MEN1 O00255 1/20 0.35
APAF1 O14727 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL70141 0.82 PTGS2 (0.52) PTGS2CYP3A4ACHELTA4HHPGD
SCHEMBL3182250 0.82 PTGS2 (0.39) PTGS2TRPA1HSPA5
SCHEMBL10421693 0.82 PTGS2 (0.39) PTGS2TRPA1HSPA5
SCHEMBL69634 0.82 ACHE (0.55) PTGS2CYP3A4ACHETRPA1LTA4H
SCHEMBL207718 0.82 PTGS2 (0.48) PTGS2CYP3A4ACHETRPA1LTA4H
SCHEMBL68667 0.79 PTGS2 (0.64) PTGS2CYP3A4ACHEALDH1A1HPGD
SCHEMBL20349305 0.78 ACHE (0.40) PTGS2CYP3A4ACHELTA4HHSP90AB1
SCHEMBL22080498 0.77 PTGS2 (0.74) PTGS2CYP3A4ACHEALDH1A1HPGD
SCHEMBL16528491 0.75 ABL1 (0.46) PTGS2CYP3A4ACHETRPA1LTA4H
SCHEMBL31200644 0.73 ALDH1A1 (0.57) PTGS2CYP3A4ACHETRPA1LTA4H

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 PTGS2 2866/4885CYP3A4 2028/4885ACHE 4447/4885

“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.