SCHEMBL70105

SCHEMBL70105

Cc1cc(C(C)C)c(O)c(Cc2c(C)c(C)cc(C(C)C)c2O)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
GABRA1 P14867 5/20 0.42
GABRB1 P18505 4/20 0.42
GABRB2 P47870 3/20 0.42
GSR P00390 1/20 0.40
TSHR P16473 2/20 0.39
GAA P10253 2/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
LMNA P02545 3/20 0.37
HIF1A Q16665 2/20 0.37
TP53 P04637 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SLC6A2 P23975 2/20 0.35
HTR2B P41595 2/20 0.35
FAAH O00519 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
SCHEMBL19235936 0.90 CYP2C19 (0.49) CA1CA2GABRA1GABRB1GABRB2
Biclotymol SCHEMBL70634 0.81 HIF1A (0.54) CA1CA2GABRA1GABRB1GABRB2
Biclotymol SCHEMBL31496050 0.81 HIF1A (0.54) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL4907907 0.79 CA1 (0.52) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL993799 0.77 GABRA1 (0.52) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL1973265 0.75 CA1 (0.48) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL8172436 0.73 GABRA1 (0.46) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL17281733 0.73 CA1 (0.56) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL214386 0.72 GABRA1 (0.46) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL1121505 0.72 GSR (0.53) CA1CA2GABRA1GABRB1GABRB2

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 CA1 550/4885CA2 612/4885GABRA1 1441/4885

“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.