SCHEMBL4875767

SCHEMBL4875767

C=CC(=O)OC12CC3CC(CC(C3)C1)C2.CCOC(C)Oc1ccc(C=CC=Cc2ccc(O)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.36
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA7 P43166 2/20 0.34
CA9 Q16790 2/20 0.34
CA14 Q9ULX7 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
XBP1 P17861 1/20 0.34
STAT3 P40763 1/20 0.34
ABCG2 Q9UNQ0 2/20 0.33
MAOB P27338 1/20 0.33
EPHX2 P34913 1/20 0.33
AKR1B10 O60218 1/20 0.32
AKR1B1 P15121 1/20 0.32
CYP17A1 P05093 1/20 0.31
CYP19A1 P11511 1/20 0.31
HDAC11 Q96DB2 2/20 0.31
HDAC1 Q13547 1/20 0.31

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
SCHEMBL3844151 0.85 GAA (0.33) ESR1CA12CA1CA2CA7
SCHEMBL5446077 0.83 ESR1 (0.36) ESR1CA12CA1CA2CA7
SCHEMBL5449150 0.82 ESR1 (0.39) ESR1CA12CA1CA2CA7
SCHEMBL5455488 0.82 CYP17A1 (0.37) ESR1CA12CA1CA2CA7
Acrylic Acid Methyl Ester SCHEMBL7263902 0.82 CA12 (0.44) CA12CA1CA2CA7CA9
SCHEMBL5449120 0.82 MAPT (0.40) ESR1CA12CA1CA2CA7
SCHEMBL5440495 0.82 KMT2A (0.41) ESR1CA12CA1CA2CA7
SCHEMBL5450986 0.81 THRB (0.46) ESR1CA12CA1CA2CA7
SCHEMBL3841430 0.81 MAPT (0.38) ESR1CA12CA1CA2CA7
SCHEMBL5435451 0.80 AKR1B10 (0.38) ESR1CA12CA7CA9CA14

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7374857-B2 Bismide compound, acid generator and resist composition each containing the same, and method of forming pattern from the composition WAKO PURE CHEMICAL INDUSTRIES LTD. (JP) 2008-05-20 US disclosed
US-20050038261-A1 Bismide compound, acid generator and resist composition each containing the same, and method of forming pattern from the composition WAKO PURE CHEMICAL INDUSTRIES LTD. (JP) 2005-02-17 US disclosed
EP-1449833-A1 BISIMIDE COMPOUND, ACID GENERATOR AND RESIST COMPOSITION EACH CONTAINING THE SAME, AND METHOD OF FORMING PATTERN FROM THE COMPOSITION Wako Pure Chemical Industries, Ltd. (JP) 2004-08-25 EP 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-20050038261-A1 Bismide compound, acid generator and resist composition each containing the same, and method of forming pattern from the composition ASIC1, GAR1, RER1 ESR1 2503/4885CA12 2989/4885CA1 603/4885

“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.