SCHEMBL875579

SCHEMBL875579

Cc1cc(OC(=O)O)no1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMPRSS15 P98073 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 8/20 0.41
NPC1 O15118 7/20 0.41
ALDH1A1 P00352 5/20 0.41
TP53 P04637 2/20 0.41
HTT P42858 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GLA P06280 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
EGFR P00533 1/20 0.40
GAA P10253 1/20 0.40
HCAR2 Q8TDS4 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 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
SCHEMBL27361867 0.84 RAB9A (0.49) TMPRSS15L3MBTL1MAPTRAB9ANPC1
SCHEMBL8305554 0.82 TMPRSS15 (0.48) TMPRSS15L3MBTL1MAPTRAB9ANPC1
SCHEMBL6632393 0.82 TMPRSS15 (0.55) TMPRSS15L3MBTL1MAPTRAB9ANPC1
SCHEMBL9844093 0.81 TMPRSS15 (0.47) TMPRSS15L3MBTL1MAPTRAB9ANPC1
SCHEMBL19520914 0.79 TMPRSS15 (0.49) TMPRSS15L3MBTL1MAPTRAB9ANPC1
SCHEMBL27952188 0.78 TMPRSS15 (0.45) TMPRSS15L3MBTL1MAPTRAB9ANPC1
SCHEMBL23723952 0.77 TMPRSS15 (0.47) TMPRSS15L3MBTL1MAPTRAB9ANPC1
SCHEMBL8846694 0.76 L3MBTL1 (0.56) TMPRSS15L3MBTL1MAPTRAB9ANPC1
SCHEMBL16571266 0.76 ALDH1A1 (0.48) MAPTRAB9ANPC1ALDH1A1TP53
SCHEMBL8964855 0.76 NPC1 (0.44) RAB9ANPC1ALDH1A1HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2635567-B1 INDOLE DERIVATIVES RICHTER GEDEON NYRT (HU) 2015-10-28 EP claimed
EP-2086993-B1 MICHAEL SYSTEMS AS TRANSGLUTAMINASE INHIBITORS ZEDIRA GMBH (DE) 2015-03-11 EP disclosed
EP-2619178-A1 SUBSTITUTED BENZAMIDE COMPOUNDS Grünenthal GmbH (DE) 2013-07-31 EP disclosed
WO-2012038081-A1 SUBSTITUTED BENZAMIDE COMPOUNDS Grünenthal GmbH (DE) 2012-03-29 WO disclosed
EP-1551830-B1 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBATORS BOEHRINGER INGELHEIM PHARMA (DE) 2009-04-08 EP disclosed
EP-1551830-A2 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBATORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-07-13 EP disclosed
WO-2004026829-A2 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-04-01 WO disclosed