SCHEMBL669564

SCHEMBL669564

C[C@H](Nc1ccc(C(=O)c2ccccc2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 1/20 0.61
MAPK12 P53778 1/20 0.61
MAPK11 Q15759 1/20 0.61
MAPK14 Q16539 1/20 0.61
ALDH1A1 P00352 8/20 0.60
RAB9A P51151 4/20 0.60
HPGD P15428 4/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
HTT P42858 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.56
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 1/20 0.53
LMNA P02545 2/20 0.50
FFAR1 O14842 1/20 0.49
SRD5A2 P31213 1/20 0.48
PTGS1 P23219 3/20 0.47
PTGS2 P35354 3/20 0.47
MAPT P10636 3/20 0.47

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
SCHEMBL669563 1.00 MAPK13 (0.61) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL1615179 0.85 ALDH1A1 (0.65) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL11453059 0.85 PTGS1 (0.55) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL11453058 0.85 PTGS1 (0.55) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL33928 0.85 TDP1 (0.56) ALDH1A1HPGDSMN1; SMN2L3MBTL1MEN1
SCHEMBL1531678 0.85 TDP1 (0.56) ALDH1A1HPGDSMN1; SMN2L3MBTL1MEN1
SCHEMBL1330911 0.85 TDP1 (0.56) ALDH1A1HPGDSMN1; SMN2L3MBTL1MEN1
SCHEMBL1331551 0.85 TDP1 (0.56) ALDH1A1HPGDSMN1; SMN2L3MBTL1MEN1
SCHEMBL33927 0.85 TDP1 (0.56) ALDH1A1HPGDSMN1; SMN2L3MBTL1MEN1
Water SCHEMBL11454954 0.83 PTGS1 (0.54) MAPK13MAPK12MAPK11MAPK14ALDH1A1

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103261167-B 6 of replacement, 6-condenses nitrogen-containing heterocycle compound and uses thereof HOFFMAN-LA ROCHE LTD. (CH) 2016-05-04 CN disclosed
CN-104302177-A Carrier for improved drug delivery EXTEND BIOSCIENCES INC 2015-01-21 CN disclosed
EP-2605789-A2 MODIFIED RELAXIN POLYPEPTIDES AND THEIR USES Ambrx, Inc. (US) 2013-06-26 EP disclosed
CN-102821775-A Pharmaceutical compositions of growth hormone secretagogue receptor ligands IPSEN PHARMA SAS 2012-12-12 CN disclosed
WO-2012024452-A2 MODIFIED RELAXIN POLYPEPTIDES AND THEIR USES AMBRX, INC. (US) 2012-02-23 WO disclosed
EP-2337795-A2 MHC MULTIMERS IN CANCER VACCINES AND IMMUNE MONITORING Dako Denmark A/S (DK) 2011-06-29 EP disclosed
CN-102076214-A Gastrin releasing peptide compounds BRACCO IMAGING SPA 2011-05-25 CN disclosed
EP-2281580-A2 Labeled gastrin releasing peptides (GRP) Bracco Imaging S.p.A (IT) 2011-02-09 EP disclosed
WO-2010037395-A2 MHC MULTIMERS IN CANCER VACCINES AND IMMUNE MONITORING DAKO DENMARK A/S (DK) 2010-04-08 WO disclosed
US-20090221483-A1 Antimicrobial Cathelicidin Peptides KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-09-03 US disclosed
US-6559141-B2 Inhibit beta-amyloid peptide release and/or synthesis, use in treating Alzheimer's disease; for example, 5-(N'-(phenylacetyl)-L-alpha-(2-thienyl)glycinyl)-amino-7-methyl-5,7-dihydro-6H-dibenz(b, d)azepin-6-one ATHENA NEUROSCIENCES, INC. 2003-05-06 US disclosed
US-6544978-B2 Treating Alzheimer's disease both prophylactically and therapeutically ATHENA NEUROSCIENCES, INC. 2003-04-08 US disclosed
US-6506782-B1 Compounds which inhibit beta -amyloid peptide release and/or its synthesis, and, accordingly, have utility in treating Alzheimer's disease. Also disclosed are pharmaceutical compositions comprising a compound which inhibits beta ATHENA NEUROSCIENCES, INC. 2003-01-14 US disclosed
WO-2002100885-A2 A PENTA- OR TETRAPEPTIDE BINDING TO SOMATOSTATIN RECEPTORS AND THE USE OF THE SAME NOVASPIN BIOTECH GMBH (DE) 2002-12-19 WO disclosed
CN-1283507-A Method of treating skin pigmentation JOHNSON & JOHNSON CONSUMER (US) 2001-02-14 CN disclosed
EP-0730605-A1 SUBSTITUTED DI- AND TRIPEPTIDE INHIBITORS OF PROTEIN:FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1996-09-11 EP disclosed
EP-0725790-A1 SUBSTITUTED TETRA- AND PENTAPEPTIDE INHIBITORS OF PROTEIN:FARNESYL TRANSFERASE PARKE DAVIS & COMPANY (US) 1996-08-14 EP disclosed
WO-1996017861-A1 SUBSTITUTED TETRA- AND PENTAPEPTIDE INHIBITORS OF PROTEIN:FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1996-06-13 WO disclosed
WO-1995012612-A1 SUBSTITUTED DI- AND TRIPEPTIDE INHIBITORS OF PROTEIN:FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1995-05-11 WO disclosed
WO-1995011917-A1 SUBSTITUTED TETRA- AND PENTAPEPTIDE INHIBITORS OF PROTEIN:FARNESYL TRANSFERASE PARKE, DAVIS & COMPANY (US) 1995-05-04 WO disclosed