SCHEMBL7900203

SCHEMBL7900203

CC(O)c1ccccc1N1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.49
KEAP1 Q14145 1/20 0.48
MAPK1 P28482 2/20 0.47
NPC1 O15118 1/20 0.46
KCNQ2 O43526 4/20 0.43
MAPT P10636 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HIF1A Q16665 1/20 0.41
ALDH1A1 P00352 1/20 0.41
EGFR P00533 1/20 0.41
RAF1 P04049 1/20 0.41
ALOX12 P18054 1/20 0.41
MAP2K1 Q02750 1/20 0.41
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL12190503 0.85 KEAP1 (0.52) GAAKEAP1MAPK1NPC1KCNQ2
SCHEMBL5795484 0.83 KEAP1 (0.55) GAAKEAP1MAPK1NPC1KCNQ2
SCHEMBL5795776 0.83 KEAP1 (0.55) GAAKEAP1MAPK1NPC1KCNQ2
SCHEMBL5793114 0.83 MC4R (0.49) GAAKEAP1MAPK1NPC1KCNQ2
SCHEMBL6379160 0.83 KEAP1 (0.47) GAAKEAP1MAPK1NPC1KCNQ2
SCHEMBL4547918 0.82 GAA (0.48) GAAKEAP1MAPK1NPC1KCNQ2
SCHEMBL1460357 0.82 L3MBTL1 (0.49) NPC1KCNQ2MAPTL3MBTL1ALDH1A1
SCHEMBL17844326 0.82 L3MBTL1 (0.49) NPC1KCNQ2MAPTL3MBTL1ALDH1A1
Propionic Acid SCHEMBL9328561 0.82 L3MBTL1 (0.45) GAAMAPTL3MBTL1ALDH1A1
SCHEMBL3804892 0.81 GAA (0.49) GAAKEAP1MAPK1NPC1KCNQ2

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-RE37035-E1 HYPOGLYCEMIC AGENTS BOEHRINGER INGELHEIM KG (DE) 2001-01-30 US disclosed
US-6143769-A ENANTIOMORPH KARL THOMAE GMBH (DE) 2000-11-07 US disclosed
US-5312924-A Compounds for lowering blood sugar and effecting metabolism DR. KARL THOMAE GMBH (DE) 1994-05-17 US disclosed
US-5216167-A Hypoglycemic agents DR. KARL THOMAE GMBH (DE) 1993-06-01 US disclosed
EP-0147850-B1 PHENYLACETIC-ACID DERIVATIVES, MEDICINES CONTAINING THESE COMPOUNDS AND PROCESS FOR THEIR PREPARATION Dr. Karl Thomae GmbH (DE) 1989-06-14 EP disclosed
US-4735959-A HYPOGLYCEMIC AGENTS DR. KARL THOMAE GMBH (DE) 1988-04-05 US disclosed
EP-0147850-A2 Phenylacetic-acid derivatives, medicines containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1985-07-10 EP disclosed
EP-0058779-B1 CARBOXAMIDES, THEIR PREPARATION AND THEIR USE AS MEDICINES Dr. Karl Thomae GmbH (DE) 1984-09-19 EP disclosed
EP-0058779-A2 Carboxamides, their preparation and their use as medicines Dr. Karl Thomae GmbH (DE) 1982-09-01 EP disclosed