SCHEMBL3081531

SCHEMBL3081531

CCC(S)C(=O)OCCOC(=O)C(S)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
TSHR P16473 2/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
RNPEP Q9H4A4 2/20 0.33
DGKA P23743 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
MME P08473 1/20 0.32
ACE P12821 1/20 0.32
CPA1 P15085 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
Ethylene SCHEMBL14964625 0.95 TSHR (0.33) ALDH1A1TSHRCA1CA2RNPEP
SCHEMBL3095134 0.93 ALDH1A1 (0.41) ALDH1A1TSHRCA1CA2RNPEP
SCHEMBL14964644 0.93 ALDH1A1 (0.41) ALDH1A1TSHRCA1CA2RNPEP
SCHEMBL31132432 0.93 ALDH1A1 (0.41) ALDH1A1TSHRCA1CA2RNPEP
SCHEMBL23581584 0.90 NAAA (0.40) ALDH1A1TSHRCA1CA2ACHE
SCHEMBL2135989 0.90 HCAR2 (0.39) ALDH1A1TSHRCA1CA2HDAC3
SCHEMBL2134905 0.86 ALDH1A1 (0.52) ALDH1A1TSHRCA1CA2ACHE
SCHEMBL26270395 0.85 TSHR (0.36) ALDH1A1TSHRCA1CA2HSD17B10
SCHEMBL1141776 0.84
SCHEMBL7980194 0.84

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
WO-2022181403-A1 PHOTOSENSITIVE COLORED RESIN COMPOSITION, CURED PRODUCT, COLOR FILTER, AND DISPLAY DEVICE 株式会社DNPファインケミカル 2022-09-01 WO disclosed
US-8283095-B2 Thiourethane compound and photosensitive resin composition SHOWA DENKO K.K. (JP) 2012-10-09 US disclosed
US-20100233596-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION SHOWA DENKO K.K. (JP) 2010-09-16 US disclosed
EP-2055726-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION Showa Denko K.K. (JP) 2009-05-06 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-20100233596-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION RCOR3, CBR3, TAS2R3 ALDH1A1 1341/4885TSHR 3601/4885CA1 1541/4885

“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.