SCHEMBL10036739

SCHEMBL10036739

Cc1ccc(CN2C(=O)CNC(=O)c3cc(Cl)ccc32)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
TP53 P04637 3/20 0.46
LMNA P02545 2/20 0.45
ALDH2 P05091 1/20 0.44
ALDH3A1 P30838 1/20 0.44
MDH2 P40926 2/20 0.42
ACHE P22303 1/20 0.41
MAPT P10636 1/20 0.41
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40

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
SCHEMBL14346543 0.88 KMT2A (0.49) GAASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL607289 0.87 KMT2A (0.46) GAAALDH1A1KMT2AMEN1MDH2
SCHEMBL30327581 0.87 KMT2A (0.46) GAAALDH1A1KMT2AMEN1MDH2
SCHEMBL10036740 0.78 TP53 (0.59) GAASMN1; SMN2ALDH1A1TP53LMNA
SCHEMBL607738 0.76 LMNA (0.51) GAAALDH1A1KMT2ALMNAGSK3B
SCHEMBL14481325 0.75 MDH2 (0.54) GAAALDH1A1KMT2AMEN1TP53
SCHEMBL8320050 0.75 SMN1; SMN2 (0.73) GAASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL1514978 0.74 CHRM5 (0.47) GAASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL14553937 0.74 MEN1 (0.45) GAAALDH1A1KMT2AMEN1MDH2
SCHEMBL13627931 0.71 CA1 (0.56) SMN1; SMN2ALDH1A1KMT2AMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20120040971-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-02-16 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 (2 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 GAA 2723/4885SMN1; SMN2 4668/4885ALDH1A1 373/4885
US-20130274197-A1 BENZODIAZEPINONE COMPOUNDS USEFUL IN THE TREATMENT OF SKIN CONDITIONS RORC, RORA, RORB GAA 2723/4885SMN1; SMN2 4668/4885ALDH1A1 373/4885

“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.