SCHEMBL609055

SCHEMBL609055

COc1ccc(CN2C(=O)C(Cc3cc(C)cc(C)c3)N=C(c3ccc(OC)cc3)c3cc(Cl)ccc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 15/20 0.45
TP53 P04637 2/20 0.43
LMNA P02545 2/20 0.41
SMCHD1 A6NHR9 1/20 0.41
MYO1G B0I1T2 1/20 0.41
AIP O00170 1/20 0.41
AP3B1 O00203 1/20 0.41
PSMD11 O00231 1/20 0.41
CDC7 O00311 1/20 0.41
SAP18 O00422 1/20 0.41
KPNA3 O00505 1/20 0.41
PPP6C O00743 1/20 0.41
TCERG1 O14776 1/20 0.41
UBE2L6 O14933 1/20 0.41
PPP1R12A O14974 1/20 0.41
U2SURP O15042 1/20 0.41
SETD1A O15047 1/20 0.41
ARPC1B O15143 1/20 0.41
POLR1C O15160 1/20 0.41
OGT O15294 1/20 0.41

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
SCHEMBL14707979 0.92 TP53 (0.51) BRD4TP53LMNA
SCHEMBL607303 0.89 LMNA (0.48) BRD4LMNASMCHD1MYO1GAIP
SCHEMBL10193350 0.88 BRD4 (0.48) BRD4LMNASMCHD1MYO1GAIP
SCHEMBL607295 0.88 BRD4 (0.44) BRD4LMNASMCHD1MYO1GAIP
SCHEMBL608170 0.88 BRD4 (0.45) BRD4TP53LMNASMCHD1MYO1G
SCHEMBL606257 0.87 BRD4 (0.43) BRD4TP53LMNASMCHD1MYO1G
SCHEMBL607650 0.87 BRD4 (0.44) BRD4LMNASMCHD1MYO1GAIP
SCHEMBL607146 0.86 BDKRB2 (0.43) BRD4TP53LMNASMCHD1MYO1G
SCHEMBL14064652 0.86 BRD4 (0.44) BRD4TP53LMNASMCHD1MYO1G
SCHEMBL606675 0.86 BDKRB2 (0.42) BRD4TP53LMNAPARK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-8188072-B2 Benzodiazepinone compounds useful in the treatment of skin conditions THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-05-29 US disclosed
US-20120040971-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-02-16 US disclosed
EP-2217576-A2 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS The Regents of the University of Michigan (US) 2010-08-18 EP disclosed
WO-2009061916-A2 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-05-14 WO 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20120040971-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS RORC, RORA, RORB BRD4 109/4885TP53 3879/4885LMNA 2002/4885
US-20090118244-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS RORC, RORA, RORB BRD4 109/4885TP53 3879/4885LMNA 2002/4885
US-20130274197-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS RORC, RORA, RORB BRD4 109/4885TP53 3879/4885LMNA 2002/4885

“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.