SCHEMBL13301154

SCHEMBL13301154

CC(=O)SCCOCCOCCOCCOCCO

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TSHR P16473 3/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.39
BLM P54132 1/20 0.39
ATM Q13315 1/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL26381747 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1CYP2C19
SCHEMBL888204 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1CYP2C19
SCHEMBL997382 1.00 MEN1 (0.48) MEN1KMT2ATSHRMAPK1CYP2C19
SCHEMBL15890590 0.98 TSHR (0.46) MEN1KMT2ATSHRMAPK1CYP2C19
SCHEMBL19999151 0.91 CYP2C19 (0.46) MEN1KMT2ATSHRCYP2C19POLB
SCHEMBL17883360 0.91 CYP2C19 (0.46) MEN1KMT2ATSHRCYP2C19POLB
SCHEMBL1777653 0.89 CYP2C19 (0.48) TSHRCYP2C19POLBBLMATM
SCHEMBL1469721 0.84 MEN1 (0.52) MEN1KMT2ATSHRMAPK1CYP2C19
SCHEMBL29518865 0.84 MEN1 (0.52) MEN1KMT2ATSHRMAPK1CYP2C19
SCHEMBL30372269 0.84 MEN1 (0.52) MEN1KMT2ATSHRMAPK1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3095467-A1 MOLECULAR CONJUGATE Ventana Medical Systems, Inc. (US) 2016-11-23 EP disclosed
US-20160195540-A1 Molecular Conjugate VENTANA MED SYST INC (US) 2016-07-07 US disclosed
US-20160195540-A1 Molecular Conjugate VENTANA MED SYST INC (US) 2016-07-07 US disclosed
US-9310373-B2 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. (US) 2016-04-12 US disclosed
US-9310373-B2 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. (US) 2016-04-12 US disclosed
EP-2963011-A1 MOLECULAR CONJUGATE Ventana Medical Systems, Inc. (US) 2016-01-06 EP disclosed
EP-1951316-B1 Molecular conjugate VENTANA MED SYST INC (US) 2015-08-19 EP disclosed
US-20140205995-A1 MOLECULAR CONJUGATE VENTANA MEDICAL SYSTEMS, INC. (US) 2014-07-24 US disclosed
US-20140205995-A1 MOLECULAR CONJUGATE VENTANA MEDICAL SYSTEMS, INC. (US) 2014-07-24 US disclosed
US-20100136652-A1 Molecular Conjugate VENTANA MEDICAL SYSTEMS, INC. 2010-06-03 US disclosed
US-20100136652-A1 Molecular Conjugate VENTANA MEDICAL SYSTEMS, INC. 2010-06-03 US disclosed
WO-2007062177-A2 MOLECULAR CONJUGATE VENTANA MEDICAL SYSTEMS, INC. (US) 2007-05-31 WO disclosed
US-20070117153-A1 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. 2007-05-24 US disclosed
US-20070117153-A1 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. 2007-05-24 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-20160195540-A1 Molecular Conjugate CA12, FCGR2A, CA14 MEN1 3359/4885KMT2A 181/4885TSHR 2108/4885
US-20100136652-A1 Molecular Conjugate CA12, FCGR2A, CA14 MEN1 3359/4885KMT2A 181/4885TSHR 2108/4885
US-20070117153-A1 Molecular conjugate CA12, FCGR2A, CA14 MEN1 3359/4885KMT2A 181/4885TSHR 2108/4885

“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.