SCHEMBL1322985

SCHEMBL1322985

CNC(=O)c1cccc(-c2ccc(NC(=O)[C@H](C)NC)c(=O)n2Cc2cc(C(=O)c3ccc(F)cc3)cc(C(F)(F)F)c2)c1C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 3/20 0.39
PPARG P37231 9/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 2/20 0.32
MAPT P10636 1/20 0.32
PTGER3 P43115 1/20 0.31
CCR1 P32246 1/20 0.31
ATM Q13315 1/20 0.31
BRD4 O60885 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
SCHEMBL1322988 1.00 KDM4E (0.41) KDM4ESMN1; SMN2HTTALDH1A1PPARG
SCHEMBL14163218 0.93 KDM4E (0.40) KDM4ESMN1; SMN2HTTALDH1A1PPARG
SCHEMBL1324357 0.92 PPARG (0.34) KDM4ESMN1; SMN2HTTALDH1A1PPARG
SCHEMBL1324355 0.92 PPARG (0.34) KDM4ESMN1; SMN2HTTALDH1A1PPARG
SCHEMBL1323852 0.90 PPARG (0.36) KDM4ESMN1; SMN2HTTPPARGMAPT
SCHEMBL1323853 0.90 PPARG (0.36) KDM4ESMN1; SMN2HTTPPARGMAPT
SCHEMBL1323157 0.90 MAPT (0.37) KDM4ESMN1; SMN2HTTALDH1A1PPARG
SCHEMBL1323163 0.90 MAPT (0.37) KDM4ESMN1; SMN2HTTALDH1A1PPARG
SCHEMBL2210167 0.89 KDM4E (0.40) KDM4ESMN1; SMN2HTTALDH1A1PPARG
SCHEMBL2213976 0.89 KDM4E (0.40) KDM4ESMN1; SMN2HTTALDH1A1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100048571-A1 Organic Compounds NOVARTIS AG 2010-02-25 US claimed
EP-2086938-A1 ORGANIC COMPOUNDS Novartis AG (CH) 2009-08-12 EP claimed
WO-2008073306-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-06-19 WO claimed
US-8058272-B2 Organic compounds NOVARTIS AG (CH) 2011-11-15 US disclosed
US-8058272-B2 Organic compounds NOVARTIS AG (CH) 2011-11-15 US disclosed
US-8058272-B2 Organic compounds NOVARTIS AG (CH) 2011-11-15 US disclosed
US-20100048571-A1 Organic Compounds NOVARTIS AG 2010-02-25 US disclosed
US-20100048571-A1 Organic Compounds NOVARTIS AG 2010-02-25 US disclosed
US-20100048571-A1 Organic Compounds NOVARTIS AG 2010-02-25 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 (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-20100048571-A1 Organic Compounds XIAP, BAX, MCL1 KDM4E 3048/4885SMN1; SMN2 1520/4885HTT 3684/4885

“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.