SCHEMBL6124673

SCHEMBL6124673

Cc1cn(-c2ccc(C=O)c3c2OCC3)cn1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EED O75530 4/20 0.37
SUZ12 Q15022 4/20 0.37
EZH2 Q15910 4/20 0.37
RBBP4 Q09028 1/20 0.35
AEBP2 Q6ZN18 1/20 0.35
PSEN1 P49768 11/20 0.34
PSEN2 P49810 11/20 0.34
APH1B Q8WW43 11/20 0.34
NCSTN Q92542 11/20 0.34
APH1A Q96BI3 11/20 0.34
PSENEN Q9NZ42 11/20 0.34
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
EGLN2 Q96KS0 1/20 0.32
KCNH2 Q12809 2/20 0.31
CYP2E1 P05181 1/20 0.31
CYP2A6 P11509 1/20 0.31

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
SCHEMBL6127897 0.83 EED (0.39) EEDSUZ12EZH2RBBP4AEBP2
SCHEMBL6124667 0.81 MAOA (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8028032 0.81 EED (0.39) EEDSUZ12EZH2RBBP4AEBP2
SCHEMBL8737804 0.81 MAOA (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6124685 0.79 EED (0.36) EEDSUZ12EZH2
SCHEMBL6124239 0.79 EED (0.37) EEDSUZ12EZH2RBBP4AEBP2
SCHEMBL8737290 0.78 EED (0.39) EEDSUZ12EZH2RBBP4AEBP2
SCHEMBL6124683 0.75 PSEN1 (0.32) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6124691 0.74 EGLN2 (0.32) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6124684 0.73 PSEN1 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8487099-B2 Gamma secretase modulators MERCK SHARP & DOHME CORP. (US) 2013-07-16 US disclosed
US-8487099-B2 Gamma secretase modulators MERCK SHARP & DOHME CORP. (US) 2013-07-16 US disclosed
US-8450343-B2 Gamma secretase modulators SCHERING CORPORATION 2013-05-28 US disclosed
US-8450343-B2 Gamma secretase modulators SCHERING CORPORATION 2013-05-28 US disclosed
US-20120129846-A1 GAMMA SECRETASE MODULATORS Merck, Sharp & Dohme, Corp. 2012-05-24 US disclosed
US-20120129846-A1 GAMMA SECRETASE MODULATORS Merck, Sharp & Dohme, Corp. 2012-05-24 US disclosed
US-20120107328-A1 GAMMA SECRETASE MODULATORS MERCK SHARP & DOHME CORP. 2012-05-03 US disclosed
US-20120107328-A1 GAMMA SECRETASE MODULATORS MERCK SHARP & DOHME CORP. 2012-05-03 US disclosed
US-20110027264-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE SCHERING CORPORATION 2011-02-03 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
US-20100298381-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2010-11-25 US disclosed
US-20100298381-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION 2010-11-25 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 (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-20120107328-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 EED 4148/4885SUZ12 3767/4885EZH2 4604/4885
US-20120129846-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 EED 3333/4885SUZ12 2303/4885EZH2 4123/4885
US-20110027264-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE BACE1, BACE2, PSEN1 EED 4208/4885SUZ12 3753/4885EZH2 4637/4885
US-20100298381-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSENEN EED 3383/4885SUZ12 2679/4885EZH2 4034/4885
US-20110015190-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 EED 4165/4885SUZ12 3566/4885EZH2 4539/4885

“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.