SCHEMBL10044232

SCHEMBL10044232

COC(=O)NC1CC(C)(C)CC(C)(CNC(C)=O)C1

nearest known ligand 0.84

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.84
TDP1 Q9NUW8 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35
ALDH1A1 P00352 1/20 0.34
KCNA3 P22001 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
SCHEMBL1021081 0.91 TSHR (1.00) TSHRTDP1OPRM1OPRL1ALDH1A1
SCHEMBL22627334 0.90 TSHR (0.86) TSHRTDP1KCNA3
SCHEMBL15171908 0.89 TSHR (0.84) TSHRTDP1
SCHEMBL1753416 0.89 TSHR (0.71) TSHRTDP1OPRM1OPRL1ALDH1A1
SCHEMBL16684434 0.89 TSHR (0.84) TSHRTDP1KCNA3
SCHEMBL10014286 0.88 TSHR (0.64) TSHRTDP1OPRM1OPRL1ALDH1A1
SCHEMBL22627154 0.87 TSHR (0.82) TSHRTDP1KCNA3
SCHEMBL10044269 0.86 TSHR (0.84) TSHRTDP1ALDH1A1
SCHEMBL12394889 0.86 TSHR (0.84) TSHRTDP1
SCHEMBL10203832 0.85 TSHR (0.61) TSHRTDP1OPRM1OPRL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170112607-A1 MULTIPURPOSE IMPLANT WITH MODELED SURFACE STRUCTURE FOR SOFT TISSUE RECONSTRUCTION IconLab USA, Inc. 2017-04-27 US disclosed
US-20170049109-A1 ANTIMICROBIAL POLYMERIC COMPOSITIONS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2017-02-23 US disclosed
US-20160096292-A1 Method of Manufacturing an Artificial Elastic Implant for Restorative an Reconstructive Surgery ICONLAB, USA, INC. 2016-04-07 US disclosed
US-20130183262-A1 ANTIMICROBIAL POLYMERIC COMPOSITIONS NAVY, SECRETARY OF THE UNITED STATES OF AMERICA 2013-07-18 US disclosed
WO-2012027729-A1 FLUORINATED ETHOXYLATED POLYURETHANES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-03-01 WO 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 (2 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-20130183262-A1 ANTIMICROBIAL POLYMERIC COMPOSITIONS SLC11A2, ARG1, NGLY1 TSHR 3398/4885TDP1 3822/4885OPRM1 736/4885
US-20170049109-A1 ANTIMICROBIAL POLYMERIC COMPOSITIONS SLC11A2, ARG1, NGLY1 TSHR 3398/4885TDP1 3822/4885OPRM1 736/4885

“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.