SCHEMBL821890

SCHEMBL821890

CC1CCCCCCOC(=O)OC12CCCCCCCCC2

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
CYP2C9 P11712 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD11B1 P28845 1/20 0.30
LMNA P02545 1/20 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
SCHEMBL17995472 0.74 TSHR (0.43) TSHRCYP2C9MAPK1LMNA
SCHEMBL1474193 0.74 TSHR (0.43) TSHRCYP2C9MAPK1ALDH1A1LMNA
SCHEMBL1474192 0.74 TSHR (0.43) TSHRCYP2C9MAPK1ALDH1A1LMNA
SCHEMBL14278564 0.68 TSHR (0.37) TSHRCYP2C9MAPK1LMNA
SCHEMBL12203799 0.67 MAPK1 (0.49) TSHRCYP2C9MAPK1ALDH1A1LMNA
SCHEMBL821246 0.67 ATM (0.35)
SCHEMBL11364805 0.66
SCHEMBL29574771 0.66 KMT2A (0.38)
SCHEMBL7649225 0.65 CA1 (0.41) ALDH1A1LMNA
SCHEMBL663720 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2390276-B1 CARBOXYL GROUP-CONTAINING POLYURETHANE SHOWA DENKO KK (JP) 2018-06-13 EP disclosed
US-8674017-B2 (Poly)carbonate polyol and carboxyl group-containing polyurethane obtained from the (poly)carbonate polyol SHOWA DENKO K.K. (JP) 2014-03-18 US disclosed
EP-2390276-A1 CARBOXYL GROUP-CONTAINING POLYURETHANE Showa Denko K.K. (JP) 2011-11-30 EP disclosed
EP-2390277-A1 (POLY)CARBONATE POLYOL AND CARBOXYL GROUP-CONTAINING POLYURETHANE USING THE (POLY)CARBONATE POLYOL AS STARTING MATERIAL Showa Denko K.K. (JP) 2011-11-30 EP disclosed
US-20110272182-A1 CARBOXYL GROUP-CONTAINING POLYURETHANE SHOWA DENKO K.K. (JP) 2011-11-10 US disclosed
US-20110272183-A1 (POLY)CARBONATE POLYOL AND CARBOXYL GROUP-CONTAINING POLYURETHANE OBTAINED FROM THE (POLY)CARBONATE POLYOL SHOWA DENKO K.K. (JP) 2011-11-10 US disclosed
US-20110257257-A1 COMPOSITION FOR TREATMENT OF EPITHELIAL TISSUE NOVODERMIX INTERNATIONAL LIMITED (VG) 2011-10-20 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-20110272183-A1 (POLY)CARBONATE POLYOL AND CARBOXYL GROUP-CONTAINING POLYURETHANE OBTAINED FROM THE (POLY)CARBONATE POLYOL PUF60, PARG, PIK3C2G TSHR 4843/4885CYP2C9 1807/4885MAPK1 3436/4885

“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.