SCHEMBL14617331

SCHEMBL14617331

C=C(C)C(=O)O[C@H]1CO[C@H]2[C@@H]1OC[C@H]2OCOC1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
BCHE P06276 11/20 0.36
KLK7 P49862 2/20 0.33
KLK5 Q9Y337 1/20 0.33
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
EPHX1 P07099 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
SCHEMBL14617351 1.00 ALDH1A1 (0.36) ALDH1A1BCHEKLK7KLK5TP53
SCHEMBL14616383 1.00 ALDH1A1 (0.36) ALDH1A1BCHEKLK7KLK5TP53
SCHEMBL14617343 0.82 ALDH1A1 (0.41) ALDH1A1BCHEKLK7KLK5
SCHEMBL14616289 0.82 ALDH1A1 (0.41) ALDH1A1BCHEKLK7KLK5
SCHEMBL16265958 0.80 ALDH1A1 (0.47) ALDH1A1BCHE
SCHEMBL15999628 0.80 ALDH1A1 (0.47) ALDH1A1BCHE
SCHEMBL16120308 0.80 ALDH1A1 (0.47) ALDH1A1BCHE
SCHEMBL26738358 0.80 ALDH1A1 (0.47) ALDH1A1BCHE
SCHEMBL14617356 0.79 BCHE (0.34) ALDH1A1BCHE
SCHEMBL14617332 0.79 BCHE (0.34) ALDH1A1BCHE

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-8795946-B2 Polymerizable ester compound, polymer, resist composition, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-08-05 US disclosed
US-8795946-B2 Polymerizable ester compound, polymer, resist composition, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-08-05 US disclosed
US-20130017484-A1 POLYMERIZABLE ESTER COMPOUND, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-01-17 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-20130017484-A1 POLYMERIZABLE ESTER COMPOUND, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS RER1, DOT1L, H1-0 ALDH1A1 1319/4885BCHE 3851/4885KLK7 3173/4885

“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.