SCHEMBL17778264

SCHEMBL17778264

C=C(C)C(=O)OCCOC(=O)C(OC(=O)CC1C2CC3CC(C2)CC1C3)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.34
HSD11B1 P28845 1/20 0.33
ALDH1A1 P00352 2/20 0.31
TSHR P16473 2/20 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
SCHEMBL17773473 0.88 THRB (0.33) THRBHSD11B1TSHR
SCHEMBL17753841 0.80 ALDH1A1 (0.33) HSD11B1ALDH1A1
SCHEMBL17778355 0.80 MAPT (0.36) THRBALDH1A1TSHR
SCHEMBL17778353 0.77 CYP17A1 (0.38) THRBALDH1A1TSHR
SCHEMBL17297646 0.76 THRB (0.46) THRBALDH1A1TSHR
SCHEMBL17779706 0.73 THRB (0.44) THRBALDH1A1TSHR
SCHEMBL17778265 0.72 THRB (0.38) THRBALDH1A1TSHR
SCHEMBL17779705 0.72 THRB (0.42) THRBALDH1A1TSHR
SCHEMBL5001408 0.72 THRB (0.43) THRBHSD11B1ALDH1A1TSHR
SCHEMBL17778354 0.71 THRB (0.37) THRBALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160145186-A1 NON-IONIC COMPOUND, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-05-26 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-20160145186-A1 NON-IONIC COMPOUND, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN AFF1, AFF2, RER1 THRB 3349/4885HSD11B1 2268/4885ALDH1A1 2381/4885

“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.