SCHEMBL258590

SCHEMBL258590

O=C(CCS)OCC1(COC(=O)CCS)CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
BLM P54132 1/20 0.33
CACNA2D1 P54289 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PRKCA P17252 2/20 0.30

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
SCHEMBL3095096 0.89 PRKCA (0.34) LMNAUSP2ALDH1A1CYP1A2TSHR
SCHEMBL3097377 0.78 CTSK (0.31)
SCHEMBL8520271 0.77 LMNA (0.41) LMNAUSP2ALDH1A1CYP1A2TSHR
Cyclopropane SCHEMBL99057 0.74 DGKA (0.41) LMNAALDH1A1BLM
SCHEMBL649542 0.73 MGAM (0.46) LMNAUSP2ALDH1A1CYP1A2TSHR
SCHEMBL3088953 0.73 CYP2C19 (0.33) LMNAUSP2ALDH1A1CYP1A2TSHR
SCHEMBL8444652 0.73 PRKCA (0.45) ALDH1A1PRKCA
SCHEMBL11437280 0.73 LMNA (0.45) LMNAUSP2ALDH1A1CYP1A2TSHR
SCHEMBL3082567 0.72 CYP2C19 (0.31)
SCHEMBL17026000 0.72 PRKCA (0.39) LMNAALDH1A1TSHRPRKCA

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-8283095-B2 Thiourethane compound and photosensitive resin composition SHOWA DENKO K.K. (JP) 2012-10-09 US disclosed
US-8063161-B2 Low temperature curing acrylate and maleimide based formulations and methods for use thereof DESIGNER MOLECULES, INC. (US) 2011-11-22 US disclosed
US-20100233596-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION SHOWA DENKO K.K. (JP) 2010-09-16 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-20100233596-A1 THIOURETHANE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION RCOR3, CBR3, TAS2R3 LMNA 4454/4885USP2 2425/4885ALDH1A1 1341/4885

“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.