SCHEMBL2986017

SCHEMBL2986017

COC(=O)C1CCC(S(=O)(=O)c2ccc(NC(=O)C(=O)NN)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 4/20 0.42
GAA P10253 2/20 0.42
MAPK1 P28482 1/20 0.42
PKM P14618 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.39
ELOVL6 Q9H5J4 2/20 0.39
DDIT3 P35638 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NAMPT P43490 4/20 0.38

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
SCHEMBL13245960 1.00 KDM4E (0.44) KDM4EALDH1A1GAAMAPK1PKM
SCHEMBL2989363 0.88 PKM (0.41) ALDH1A1GAAPKMMAPTKMT2A
SCHEMBL13245961 0.88 PKM (0.41) ALDH1A1GAAPKMMAPTKMT2A
SCHEMBL13245962 0.80 PKM (0.46) ALDH1A1PKMMAPTTSHRHPGD
SCHEMBL2989019 0.80 PKM (0.46) ALDH1A1PKMMAPTTSHRHPGD
SCHEMBL3549948 0.80 KDM4E (0.49) KDM4EALDH1A1GAAMAPK1MAPT
SCHEMBL3549945 0.80 KDM4E (0.49) KDM4EALDH1A1GAAMAPK1MAPT
SCHEMBL30267353 0.79 ALDH1A1 (0.47) ALDH1A1PKMMAPTKMT2AELOVL6
SCHEMBL15152644 0.78 L3MBTL1 (0.47) MAPK1PKMMAPTKMT2AELOVL6
SCHEMBL15152645 0.78 L3MBTL1 (0.47) MAPK1PKMMAPTKMT2AELOVL6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100173958-A1 COMPOUNDS FOR THE INHIBITION OF DGAT1 ACTIVITY ASTRAZENECA AB (SE) 2010-07-08 US disclosed
EP-2032547-A1 COMPOUNDS FOR THE INHIBITION OF DGAT1 ACTIVITY AstraZeneca AB (SE) 2009-03-11 EP disclosed
WO-2007141545-A1 COMPOUNDS FOR THE INHIBITION OF DGAT1 ACTIVITY ASTRAZENECA AB (SE) 2007-12-13 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 (1 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-20100173958-A1 COMPOUNDS FOR THE INHIBITION OF DGAT1 ACTIVITY DGAT1, DGAT2, ACAT2 KDM4E 3354/4885ALDH1A1 142/4885GAA 268/4885

“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.