SCHEMBL2196772

SCHEMBL2196772

O=C(O)CCOc1ccc(NC(=O)c2ccccc2O)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.69
KMT2A Q03164 7/20 0.69
NPC1 O15118 5/20 0.69
RAB9A P51151 5/20 0.69
LMNA P02545 4/20 0.69
TP53 P04637 3/20 0.69
HTT P42858 3/20 0.69
KDM4E B2RXH2 3/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
PNLIP P16233 5/20 0.66
HSD17B10 Q99714 2/20 0.60
HPGD P15428 1/20 0.60
POLB P06746 3/20 0.58
PPARA Q07869 1/20 0.56
NFKB1 P19838 1/20 0.55
NFKB2 Q00653 1/20 0.55
RELA Q04206 1/20 0.55
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2C9 P11712 2/20 0.51

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
SCHEMBL12427905 0.83 MAPT (0.73) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL27347841 0.82 RAB9A (1.00) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL30307513 0.82 RAB9A (1.00) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL22192202 0.80 MAPT (0.61) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL19077945 0.79 ALOX15 (0.68) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL18327174 0.79 LMNA (0.89) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL5656688 0.78 LMNA (0.64) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL12427902 0.78 NPC1 (0.60) MEN1KMT2ANPC1RAB9ALMNA
Salicylanilide SCHEMBL14051034 0.77 MEN1 (1.00) MEN1KMT2ANPC1RAB9ALMNA
Salicylanilide SCHEMBL152221 0.77 MEN1 (1.00) MEN1KMT2ANPC1RAB9ALMNA

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
EP-1246792-B1 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECH INC (US) 2014-08-13 EP disclosed
EP-1246792-B1 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECH INC (US) 2014-08-13 EP disclosed
US-7977506-B2 Amino acid for delivering active materials; bioavailability EMISPHERE TECHNOLOGIES, INC. (US) 2011-07-12 US disclosed
US-7977506-B2 Amino acid for delivering active materials; bioavailability EMISPHERE TECHNOLOGIES, INC. (US) 2011-07-12 US disclosed
US-7977506-B2 Amino acid for delivering active materials; bioavailability EMISPHERE TECHNOLOGIES, INC. (US) 2011-07-12 US disclosed
US-20070087958-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2007-04-19 US disclosed
US-20070087958-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2007-04-19 US disclosed
US-20070087958-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2007-04-19 US disclosed
US-7151191-B2 Compounds and compositions for delivering active agents EMISPHERE TECHNOLOGIES, INC. (US) 2006-12-19 US disclosed
EP-1246792-A4 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECH INC (US) 2005-02-16 EP disclosed
US-20030149296-A1 Compounds and compositions for delivering active agents NOVO NORDISK NORTH AMERICA OPERATIONS A/S (DK) 2003-08-07 US disclosed
EP-1246792-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS Emisphere Technologies, Inc. (US) 2002-10-09 EP disclosed
WO-2001051454-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2001-07-19 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-20070087958-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS SERPINB1, ELANE, MMP8 MEN1 1531/4885KMT2A 4537/4885NPC1 52/4885
US-20030149296-A1 Compounds and compositions for delivering active agents SERPINB1, ELANE, MMP8 MEN1 1531/4885KMT2A 4537/4885NPC1 52/4885

“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.