SCHEMBL6124997

SCHEMBL6124997

O=C1Nc2ccc(Cl)cc2C(c2ccc(O)cc2)=NC1c1ccc2ccccc2c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
MEN1 O00255 1/20 0.55
ALB P02768 1/20 0.55
KMT2A Q03164 1/20 0.55
CHRM1 P11229 5/20 0.50
CCKBR P32239 4/20 0.48
PGR P06401 1/20 0.47
CNR1 P21554 1/20 0.42
NTSR1 P30989 1/20 0.42
OPRK1 P41145 1/20 0.42
PDE4D Q08499 1/20 0.42

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
SCHEMBL8724250 0.88 LMNA (0.67) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL10098855 0.81 CCKBR (0.57) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL21272235 0.80 LMNA (0.71) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL10149196 0.78 OPRK1 (0.57) LMNAALBCCKBROPRK1PDE4D
SCHEMBL11633050 0.78 LMNA (0.79) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL9060504 0.77 LMNA (0.59) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL9183388 0.75 LMNA (0.67) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL11964614 0.75 CCKBR (0.68) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL8726517 0.74 CCKBR (0.61) MEN1KMT2ACHRM1CCKBR
SCHEMBL10203612 0.74 CCKBR (0.61) LMNAMEN1ALBKMT2ACHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8168626-B2 Benzodiazepine compositions for treating epidermal hyperplasia and related disorders THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-05-01 US disclosed
US-8168626-B2 Benzodiazepine compositions for treating epidermal hyperplasia and related disorders THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-05-01 US disclosed
US-20120077805-A1 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-03-29 US disclosed
US-7994313-B2 Unsolvated benzodiazepine compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-08-09 US disclosed
US-7994313-B2 Unsolvated benzodiazepine compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-08-09 US disclosed
US-20100222310-A1 BENZODIAZEPINE COMPOSITIONS FOR TREATING EPIDERMAL HYPERPLASIA AND RELATED DISORDERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-09-02 US disclosed
US-20100222310-A1 BENZODIAZEPINE COMPOSITIONS FOR TREATING EPIDERMAL HYPERPLASIA AND RELATED DISORDERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-09-02 US disclosed
US-7683046-B2 Benzodiazepine compositions for treating epidermal hyperplasia and related disorders THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-03-23 US disclosed
US-7683046-B2 Benzodiazepine compositions for treating epidermal hyperplasia and related disorders THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-03-23 US disclosed
US-20090275099-A1 Methods and compositions for treating diseases and conditions associated with mitochondrial function REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-11-05 US disclosed
US-20090253686-A1 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-10-08 US disclosed
US-20090253686-A1 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-10-08 US disclosed
US-20080269203-A1 COMPOSITIONS AND METHODS RELATING TO NOVEL COMPOUNDS AND TARGETS THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-10-30 US disclosed
US-20080269203-A1 COMPOSITIONS AND METHODS RELATING TO NOVEL COMPOUNDS AND TARGETS THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-10-30 US disclosed
WO-2008116156-A2 METHODS AND COMPOSITIONS FOR TREATING DISEASES AND CONDITIONS ASSOCIATED WITH MITOCHONDRIAL FUNCTION THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-09-25 WO disclosed
US-7276348-B2 Compositions and methods relating to F1F0-ATPase inhibitors and targets thereof REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-10-02 US disclosed
US-7276348-B2 Compositions and methods relating to F1F0-ATPase inhibitors and targets thereof REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-10-02 US disclosed
WO-2007053193-A2 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-05-10 WO disclosed
US-20070043033-A1 Unsolvated benzodiazepine compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-02-22 US disclosed
US-20070043033-A1 Unsolvated benzodiazepine compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-02-22 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 (6 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-20100222310-A1 BENZODIAZEPINE COMPOSITIONS FOR TREATING EPIDERMAL HYPERPLASIA AND RELATED DISORDERS VDR, CYP2R1, CYP24A1 LMNA 2190/4885MEN1 4163/4885ALB 3296/4885
US-20090275099-A1 Methods and compositions for treating diseases and conditions associated with mitochondrial function ATP5F1A, ATP5MF, MT-ATP6 LMNA 2704/4885MEN1 3855/4885ALB 3662/4885
US-20120077805-A1 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS GABRA5, GABRA3, GABRA6 LMNA 1390/4885MEN1 3952/4885ALB 2710/4885
US-20070043033-A1 Unsolvated benzodiazepine compositions and methods GABRA5, GABRA3, GABRA6 LMNA 1390/4885MEN1 3952/4885ALB 2710/4885
US-20090253686-A1 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS GABRA5, GABRA3, GABRA6 LMNA 1390/4885MEN1 3952/4885ALB 2710/4885
US-20080269203-A1 COMPOSITIONS AND METHODS RELATING TO NOVEL COMPOUNDS AND TARGETS THEREOF BAX, BAD, GABRB3 LMNA 2518/4885MEN1 4503/4885ALB 4455/4885

“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.