SCHEMBL70636

SCHEMBL70636

Cc1cc(Cc2cc(C)c(O)c(Cl)c2)cc(Cl)c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.55
HMGB1 P09429 1/20 0.52
CXCL12 P48061 1/20 0.52
SIRT1 Q96EB6 1/20 0.46
ESR1 P03372 2/20 0.45
ESR2 Q92731 2/20 0.45
HSD17B10 Q99714 5/20 0.40
CYP3A4 P08684 4/20 0.40
PTGS1 P23219 3/20 0.40
PTGS2 P35354 3/20 0.40
TSHR P16473 3/20 0.40
CYP2C19 P33261 3/20 0.40
ALOX15 P16050 3/20 0.40
RECQL P46063 2/20 0.40
CYP1A2 P05177 2/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HIF1A Q16665 2/20 0.40
THRB P10828 2/20 0.40
CHRM1 P11229 2/20 0.40

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
SCHEMBL3032085 0.98 SHBG (0.53) SHBGHMGB1CXCL12SIRT1ESR1
SCHEMBL6345069 0.89 HMGB1 (0.47) SHBGHMGB1CXCL12ESR1ESR2
SCHEMBL10826440 0.89 SHBG (0.46) SHBGHMGB1CXCL12SIRT1ESR1
SCHEMBL10944102 0.89 ESR1 (0.50) SHBGHMGB1CXCL12ESR1ESR2
SCHEMBL10826318 0.89 SHBG (0.46) SHBGHMGB1CXCL12SIRT1ESR1
SCHEMBL10826441 0.87 ALOX5 (0.47) SHBGHMGB1CXCL12SIRT1ESR1
SCHEMBL15368850 0.86 PTGS1 (0.52) SHBGHMGB1CXCL12SIRT1ESR1
SCHEMBL8445153 0.84 PTGS1 (0.43) SHBGHMGB1CXCL12SIRT1ESR1
SCHEMBL10826232 0.84 PTGS1 (0.45) SHBGHMGB1CXCL12SIRT1ESR1
SCHEMBL10826347 0.83 AKR1C2 (0.41) SHBGHMGB1CXCL12ESR1ESR2

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 SHBG 4659/4885HMGB1 3986/4885CXCL12 4674/4885

“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.