SCHEMBL607255

SCHEMBL607255

COc1ccc(C2=NCC(=O)N(C)c3ccc(Cl)cc32)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.81
GAA P10253 1/20 0.81
TSPO P30536 1/20 0.81
GABRA1 P14867 9/20 0.74
GABRA5 P31644 9/20 0.74
GABRA2 P47869 9/20 0.74
GABRG2 P18507 8/20 0.74
GABRB3 P28472 8/20 0.74
GABRA3 P34903 8/20 0.74
GABRB2 P47870 6/20 0.74
GABRP O00591 2/20 0.74
GABRD O14764 2/20 0.74
GABRB1 P18505 2/20 0.74
GABRA4 P48169 2/20 0.74
GABRE P78334 2/20 0.74
GABRA6 Q16445 2/20 0.74
GABRG1 Q8N1C3 2/20 0.74
GABRG3 Q99928 2/20 0.74
GABRQ Q9UN88 2/20 0.74
CACNA1F O60840 1/20 0.74

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
SCHEMBL2268100 0.91 LMNA (0.67) LMNAGAATSPOGABRA1GABRA5
Ro-54864 SCHEMBL29754019 0.90 LMNA (1.00) LMNAGAATSPOGABRA1GABRA5
Ro-54864 SCHEMBL60200 0.90 LMNA (1.00) LMNAGAATSPOGABRA1GABRA5
SCHEMBL29244910 0.86 LMNA (0.63) LMNAGAATSPOGABRA1GABRA5
SCHEMBL30327558 0.86 LMNA (0.63) LMNAGAATSPOGABRA1GABRA5
SCHEMBL11631556 0.85 LMNA (0.85) LMNAGAATSPOGABRA1GABRA5
SCHEMBL9472656 0.85 LMNA (0.85) LMNAGAATSPOGABRA1GABRA5
SCHEMBL30327572 0.85 LMNA (0.62) LMNAGAATSPOGABRA1GABRA5
Diazepam SCHEMBL21442 0.85 GABRA1 (1.00) LMNAGAATSPOGABRA1GABRA5
Diazepam SCHEMBL1019217 0.85 GABRA1 (1.00) LMNAGAATSPOGABRA1GABRA5

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4898861-A ADMINISTERING BENZODIAZEPINE COMPOUNDS, SELECTIVE AFFINITY FOR BINDING SITES ON CELL HOFFMANN-LA ROCHE INC. (US) 1990-02-06 US claimed
EP-2217576-B1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS UNIV MICHIGAN (US) 2016-05-11 EP disclosed
US-8759340-B2 Benzodiazepinone compounds useful in the treatment of skin conditions THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-06-24 US disclosed
US-20130274197-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-10-17 US disclosed
US-8461153-B2 Benzodiazepinone compounds useful in the treatment of skin conditions THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-06-11 US disclosed
EP-2139331-B1 COMPOSITIONS AND METHODS RELATING TO NOVEL COMPOUNDS AND TARGETS THEREOF UNIV MICHIGAN (US) 2013-02-20 EP disclosed
EP-2139331-B1 COMPOSITIONS AND METHODS RELATING TO NOVEL COMPOUNDS AND TARGETS THEREOF UNIV MICHIGAN (US) 2013-02-20 EP disclosed
US-20120289498-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-11-15 US disclosed
US-20120289498-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-11-15 US disclosed
US-8242109-B2 Compositions and methods relating to novel compounds and targets thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-08-14 US disclosed
US-7851465-B2 Compositions and methods relating to novel compounds and targets thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-12-14 US disclosed
US-7851465-B2 Compositions and methods relating to novel compounds and targets thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-12-14 US disclosed
EP-2139331-A1 COMPOSITIONS AND METHODS RELATING TO NOVEL COMPOUNDS AND TARGETS THEREOF The Regents of the University of Michigan (US) 2010-01-06 EP disclosed
US-20090118244-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-05-07 US disclosed
US-20080269194-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-10-30 US disclosed
US-20080269194-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-10-30 US disclosed
US-20080269194-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-10-30 US disclosed
WO-2008112553-A1 COMPOSITIONS AND METHODS RELATING TO NOVEL COMPOUNDS AND TARGETS THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-09-18 WO disclosed
WO-2008112553-A1 COMPOSITIONS AND METHODS RELATING TO NOVEL COMPOUNDS AND TARGETS THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-09-18 WO disclosed
US-4898861-A ADMINISTERING BENZODIAZEPINE COMPOUNDS, SELECTIVE AFFINITY FOR BINDING SITES ON CELL HOFFMANN-LA ROCHE INC. (US) 1990-02-06 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 (4 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-20080269194-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof BAX, BAD, BAK1 LMNA 2006/4885GAA 2662/4885TSPO 86/4885
US-20090118244-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS RORC, RORA, RORB LMNA 2002/4885GAA 2723/4885TSPO 554/4885
US-20130274197-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS RORC, RORA, RORB LMNA 2002/4885GAA 2723/4885TSPO 554/4885
US-20120289498-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof BAX, BAD, BAK1 LMNA 2006/4885GAA 2662/4885TSPO 86/4885

“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.