SCHEMBL607650

SCHEMBL607650

COc1ccc(CN2C(=O)C(Cc3ccc(C)c(C)c3)N=C(c3ccc(O)cc3)c3cc(Cl)ccc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 17/20 0.44
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
PPM1G O15355 1/20 0.41
SLC16A3 O15427 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
SCHEMBL607295 0.90 BRD4 (0.44) BRD4SMCHD1MYO1GAIPAP3B1
SCHEMBL605629 0.88 BRD4 (0.42) BRD4SMCHD1MYO1GAIPAP3B1
SCHEMBL609055 0.87 BRD4 (0.45) BRD4SMCHD1MYO1GAIPAP3B1
SCHEMBL14707979 0.86 TP53 (0.51) BRD4LMNABDKRB2
SCHEMBL608170 0.86 BRD4 (0.45) BRD4SMCHD1MYO1GAIPAP3B1
SCHEMBL606257 0.85 BRD4 (0.43) BRD4SMCHD1MYO1GAIPAP3B1
SCHEMBL8985784 0.85 OPRK1 (0.51) BRD4LMNAKCNH2HDAC3HDAC6
SCHEMBL10193350 0.85 BRD4 (0.48) BRD4SMCHD1MYO1GAIPAP3B1
SCHEMBL607146 0.84 BDKRB2 (0.43) BRD4SMCHD1MYO1GAIPAP3B1
SCHEMBL12172317 0.84 BRD4 (0.41) BRD4SMCHD1MYO1GAIPAP3B1

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 109/4885SMCHD1 4659/4885MYO1G 4694/4885
US-20090118244-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS RORC, RORA, RORB BRD4 109/4885SMCHD1 4659/4885MYO1G 4694/4885
US-20130274197-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS RORC, RORA, RORB BRD4 109/4885SMCHD1 4659/4885MYO1G 4694/4885

“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.