SCHEMBL915484

SCHEMBL915484

COC(=O)C(=Cc1ccccc1)C(=O)C(C)C

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
MAPT P10636 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.42

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
SCHEMBL915483 1.00 MEN1 (0.51) MEN1KMT2AMAPTNPSR1HPGD
SCHEMBL77732 0.88 MEN1 (0.63) MEN1KMT2AMAPTNPSR1HPGD
SCHEMBL7380055 0.85 MEN1 (0.50) MEN1KMT2AMAPTNPSR1HPGD
SCHEMBL7380054 0.85 MEN1 (0.50) MEN1KMT2AMAPTNPSR1HPGD
SCHEMBL3181449 0.84 MEN1 (0.53) MEN1KMT2AMAPTNPSR1
SCHEMBL5101671 0.84 MEN1 (0.53) MEN1KMT2AMAPTNPSR1
SCHEMBL3181455 0.84 MEN1 (0.53) MEN1KMT2AMAPTNPSR1
SCHEMBL1634878 0.83 MEN1 (0.79) MEN1KMT2AMAPTNPSR1HPGD
SCHEMBL1633388 0.83 MEN1 (0.79) MEN1KMT2AMAPTNPSR1HPGD
SCHEMBL2856643 0.82 HTT (0.56) MEN1KMT2AMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9562052-B2 Bicyclicpyridine derivatives HOFFMANN-LA ROCHE INC. (US) 2017-02-07 US disclosed
US-20150368256-A1 NEW BICYCLICPYRIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2015-12-24 US disclosed
EP-2245008-B1 METHOD FOR THE PREPARATION OF ATORVASTATIN AND INTERMEDIATES USED THEREIN CHONG KUN DANG PHARM CORP (KR) 2013-02-20 EP disclosed
US-8178697-B2 Method for the preparation of atorvastatin and intermediates used therein CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2012-05-15 US disclosed
US-20110015407-A1 METHOD FOR THE PREPARATION OF ATORVASTATIN AND INTERMEDIATES USED THEREIN CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2011-01-20 US disclosed
EP-2245008-A1 METHOD FOR THE PREPARATION OF ATORVASTATIN AND INTERMEDIATES USED THEREIN Chong Kun Dang Pharmaceutical Corp. (KR) 2010-11-03 EP disclosed
WO-2009093776-A1 METHOD FOR THE PREPARATION OF ATORVASTATIN AND INTERMEDIATES USED THEREIN CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2009-07-30 WO disclosed
WO-2006110918-A1 PYRROLE COMPOUNDS AND USES THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2006-10-19 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 (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-20150368256-A1 NEW BICYCLICPYRIDINE DERIVATIVES CACNA1E, CHRM1, CHRM2 MEN1 906/4885KMT2A 1883/4885MAPT 2019/4885
US-20110015407-A1 METHOD FOR THE PREPARATION OF ATORVASTATIN AND INTERMEDIATES USED THEREIN HMGCR, PCSK9, CETP MEN1 2601/4885KMT2A 3769/4885MAPT 4286/4885

“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.