SCHEMBL70141

SCHEMBL70141

CCCc1cc(O)cc(S)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.52
CYP3A4 P08684 1/20 0.52
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
LTA4H P09960 1/20 0.40
PTPN1 P18031 2/20 0.40
PTPN11 Q06124 2/20 0.40
GPR84 Q9NQS5 2/20 0.39
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ACHE P22303 1/20 0.36
CALM1 P0DP23 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
SCHEMBL68667 0.88 PTGS2 (0.64) PTGS2CYP3A4GPR84NPC1HPGD
SCHEMBL22080498 0.86 PTGS2 (0.74) PTGS2CYP3A4CNR1CNR2GPR84
SCHEMBL3362484 0.84 PTGS2 (0.62) PTGS2CYP3A4CNR1CNR2LTA4H
SCHEMBL67909 0.84 PTGS2 (0.70) PTGS2CYP3A4CNR1CNR2LTA4H
SCHEMBL69902 0.82 PTGS2 (0.40) PTGS2CYP3A4LTA4HGPR84HPGD
SCHEMBL16527886 0.77 PTGS2 (0.56) PTGS2CYP3A4CNR1CNR2LTA4H
SCHEMBL5168458 0.77 PTGS2 (0.56) PTGS2CYP3A4CNR1CNR2LTA4H
SCHEMBL5164535 0.76 PTGS2 (0.72) PTGS2CYP3A4GPR84NPC1HPGD
SCHEMBL3959592 0.76 PTGS2 (0.54) PTGS2CYP3A4CNR1CNR2LTA4H
SCHEMBL20349305 0.75 ACHE (0.40) PTGS2CYP3A4LTA4HACHE

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 2028/4885CNR1 3210/4885

“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.