SCHEMBL8022167

SCHEMBL8022167

Cc1ccc(Cn2cc(Br)c(=O)[nH]c2=O)cc1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
ALDH1A1 P00352 1/20 0.62
HPGD P15428 1/20 0.59
DTYMK P23919 1/20 0.59
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51

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
SCHEMBL7840035 0.85 MEN1 (0.71) MEN1KMT2AALDH1A1HPGDDTYMK
SCHEMBL12501006 0.84 KMT2A (0.66) MEN1KMT2AALDH1A1HPGDDTYMK
SCHEMBL1717207 0.84 MEN1 (0.78) MEN1KMT2AHPGDDTYMK
SCHEMBL14826582 0.81 HPGD (0.59) HPGD
SCHEMBL5117502 0.81 HPGD (0.72) HPGD
SCHEMBL12169429 0.81 HPGD (0.59) HPGD
SCHEMBL17243354 0.80 HPGD (0.54) HPGD
SCHEMBL4486235 0.80 KMT2A (0.60) MEN1KMT2AALDH1A1HPGDDTYMK
SCHEMBL17243361 0.79 HPGD (0.52) HPGD
SCHEMBL14232070 0.78 HPGD (0.72) HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8450343-B2 Gamma secretase modulators SCHERING CORPORATION 2013-05-28 US disclosed
US-20120245158-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2012-09-27 US disclosed
US-20120238546-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2012-09-20 US disclosed
US-20120232108-A1 GAMMA SECRETASE MODULATORS Merck, Sharp & Dohme, Corp. 2012-09-13 US disclosed
US-20110027264-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE SCHERING CORPORATION 2011-02-03 US disclosed
US-20110015190-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2011-01-20 US disclosed
WO-2009108766-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER ' S DISEASE SCHERING CORPORATION (US) 2009-09-03 WO 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 (5 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-20120232108-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 MEN1 3454/4885KMT2A 3709/4885ALDH1A1 1670/4885
US-20120245158-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 MEN1 3454/4885KMT2A 3709/4885ALDH1A1 1670/4885
US-20110027264-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE BACE1, BACE2, PSEN1 MEN1 3855/4885KMT2A 3325/4885ALDH1A1 1704/4885
US-20120238546-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 MEN1 3509/4885KMT2A 3871/4885ALDH1A1 1719/4885
US-20110015190-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 MEN1 3833/4885KMT2A 3472/4885ALDH1A1 2217/4885

“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.