SCHEMBL3090733

SCHEMBL3090733

CC(S)C(=O)OCC1(COC(=O)C(C)S)CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 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
CTSK P43235 2/20 0.32
MME P08473 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
SCHEMBL3090784 0.81 CTSK (0.33) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL3091222 0.81 MME (0.36) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL3088953 0.80 CYP2C19 (0.33) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL3097377 0.78 CTSK (0.31) CTSK
SCHEMBL3082711 0.76 USP2 (0.32) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL7195368 0.75 LMNA (0.39) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL3098053 0.74 CYP2C19 (0.32)
SCHEMBL30683844 0.73 ALDH1A1 (0.40) USP2ALDH1A1LMNACYP1A2TSHR
SCHEMBL3089572 0.72
SCHEMBL3202013 0.72 CTSK (0.41) ALDH1A1LMNABLMSMN1; SMN2CTSK

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-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 USP2 2425/4885ALDH1A1 1341/4885LMNA 4454/4885

“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.