SCHEMBL10170752

SCHEMBL10170752

C=C(C)C(=C)OCCOCC(=O)OC1(C)C2CC3CC(C2)CC1C3

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 2/20 0.39
CYP19A1 P11511 2/20 0.39
THRB P10828 1/20 0.32

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
SCHEMBL950092 0.90 THRB (0.44) CYP17A1CYP19A1THRB
SCHEMBL24592077 0.88 CYP17A1 (0.42) CYP17A1CYP19A1
SCHEMBL2611762 0.83 CYP17A1 (0.41) CYP17A1CYP19A1THRB
SCHEMBL10177502 0.82 TSHR (0.45) CYP17A1CYP19A1THRB
SCHEMBL10229824 0.82 CYP17A1 (0.40) CYP17A1CYP19A1
SCHEMBL214191 0.80 CYP17A1 (0.42) CYP17A1CYP19A1THRB
SCHEMBL948817 0.79 CYP17A1 (0.44) CYP17A1CYP19A1
SCHEMBL953337 0.79 CYP17A1 (0.40) CYP17A1CYP19A1
SCHEMBL824307 0.79 CYP17A1 (0.38) CYP17A1CYP19A1
SCHEMBL12017741 0.79 CYP17A1 (0.38) CYP17A1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124313-B2 Resist composition, method of forming resist pattern, novel compound, and acid generator TOKYO OHKA KOGYO CO., LTD. (JP) 2012-02-28 US disclosed
US-8124313-B2 Resist composition, method of forming resist pattern, novel compound, and acid generator TOKYO OHKA KOGYO CO., LTD. (JP) 2012-02-28 US disclosed
US-20100121077-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, NOVEL COMPOUND, AND ACID GENERATOR TOKYO OHKA KOGYO CO., LTD. (JP) 2010-05-13 US disclosed
US-20100121077-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, NOVEL COMPOUND, AND ACID GENERATOR TOKYO OHKA KOGYO CO., LTD. (JP) 2010-05-13 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-20100121077-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, NOVEL COMPOUND, AND ACID GENERATOR RER1, ABCC1, SLC11A2 CYP17A1 577/4885CYP19A1 182/4885THRB 3505/4885

“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.