SCHEMBL6064569

SCHEMBL6064569

CCc1c(CC)c(CC)c(N=C=O)c(Cc2ccccc2N=C=O)c1CC

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.53
GABRB2 P47870 2/20 0.53
CYP3A4 P08684 1/20 0.40
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
SIGMAR1 Q99720 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
SCHEMBL9561234 0.82 GABRA1 (0.45) GABRA1GABRB2CYP3A4GRIN2DGRIN3B
SCHEMBL93290 0.80 GABRA1 (0.61) GABRA1GABRB2CYP3A4GRIN2DGRIN3B
SCHEMBL29795971 0.80 GABRA1 (0.61) GABRA1GABRB2CYP3A4GRIN2DGRIN3B
SCHEMBL11865662 0.79 CYP3A4 (0.48) GABRA1GABRB2CYP3A4
SCHEMBL29404189 0.78 CYP3A4 (0.50) GABRA1GABRB2CYP3A4
SCHEMBL15544 0.78 CYP3A4 (0.50) GABRA1GABRB2CYP3A4
SCHEMBL18701450 0.78 CYP3A4 (0.50) GABRA1GABRB2CYP3A4
SCHEMBL23721618 0.77 GABRA1 (0.58) GABRA1GABRB2CYP3A4
SCHEMBL1396461 0.77 GABRA1 (0.58) GABRA1GABRB2CYP3A4
SCHEMBL17504402 0.77 GABRA1 (0.58) GABRA1GABRB2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4511077-A1 BONE REPAIR COMPOSITIONS COMPRISING POLYTHIOURETHANE AND USES THEREOF Smith&Nephew, Inc. (US) 2025-02-26 EP claimed
WO-2023205141-A1 BONE REPAIR COMPOSITIONS COMPRISING POLYTHIOURETHANE AND USES THEREOF SMITH & NEPHEW, INC. (US) 2023-10-26 WO claimed
US-9084827-B2 Biodegradable polyurethane/urea compositions POLYNOVO BIOMATERIALS PTY LIMITED (AU) 2015-07-21 US claimed
US-20140099277-A1 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS POLYNOVO BIOMATERIALS PTY LIMITED (AU) 2014-04-10 US claimed
US-20130150964-A1 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS POLYNOVO BIOMATERIALS PTY LIMITED (AU) 2013-06-13 US claimed
US-20250262347-A1 BONE REPAIR COMPOSITIONS COMPRISING POLYTHIOURETHANE AND USES THEREOF SMITH & NEPHEW INC (US) 2025-08-21 US disclosed
EP-4511077-A1 BONE REPAIR COMPOSITIONS COMPRISING POLYTHIOURETHANE AND USES THEREOF Smith&Nephew, Inc. (US) 2025-02-26 EP disclosed
WO-2023205141-A1 BONE REPAIR COMPOSITIONS COMPRISING POLYTHIOURETHANE AND USES THEREOF SMITH & NEPHEW, INC. (US) 2023-10-26 WO disclosed
EP-3042920-A1 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS Polynovo Biomaterials Pty Limited (AU) 2016-07-13 EP disclosed
CN-1774460-B Biodegradable polyurethane/urea compositions COMMW SCIENT IND RES ORG 2010-04-21 CN disclosed
CN-1774460-A Biodegradable polyurethane/urea compositions COMMW SCIENT IND RES ORG (AU) 2006-05-17 CN disclosed
EP-1572339-A4 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS COMMW SCIENT IND RES ORG (AU) 2006-04-19 EP disclosed
EP-1572339-A2 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2005-09-14 EP disclosed
WO-2004009227-A2 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2004-01-29 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 (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-20140099277-A1 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS PUF60, UMPS, COL2A1 GABRA1 3692/4885GABRB2 3541/4885CYP3A4 2965/4885

“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.