SCHEMBL5795776

SCHEMBL5795776

CC(N)c1ccccc1N1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.55
GAA P10253 2/20 0.50
MAPK1 P28482 2/20 0.48
NPC1 O15118 1/20 0.47
MAPT P10636 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 1/20 0.42
EGFR P00533 1/20 0.42
RAF1 P04049 1/20 0.42
ALOX12 P18054 1/20 0.42
MAP2K1 Q02750 1/20 0.42
KCNQ2 O43526 1/20 0.41
PTGS2 P35354 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
HIF1A Q16665 1/20 0.39
NCF1 P14598 3/20 0.39
ADRB1 P08588 1/20 0.39
ADRA2C P18825 1/20 0.39
MC4R P32245 1/20 0.39

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
SCHEMBL5795484 1.00 KEAP1 (0.55) KEAP1GAAMAPK1NPC1MAPT
Hydrochloric Acid SCHEMBL10677507 0.98 KEAP1 (0.53) KEAP1GAAMAPK1NPC1MAPT
SCHEMBL6379160 0.88 KEAP1 (0.47) KEAP1GAAMAPK1NPC1MAPT
SCHEMBL12190503 0.86 KEAP1 (0.52) KEAP1GAAMAPK1NPC1MAPT
SCHEMBL524503 0.86 KEAP1 (0.44) KEAP1GAAMAPK1NPC1MAPT
SCHEMBL1964089 0.84 MC4R (0.54) KEAP1GAAMAPK1NPC1KCNQ2
SCHEMBL31388217 0.84 MC4R (0.54) KEAP1GAAMAPK1NPC1KCNQ2
SCHEMBL442668 0.84 MC4R (0.54) KEAP1GAAMAPK1NPC1KCNQ2
SCHEMBL17871701 0.84 MC4R (0.54) KEAP1GAAMAPK1NPC1KCNQ2
SCHEMBL31128130 0.84 MC4R (0.54) KEAP1GAAMAPK1NPC1KCNQ2

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
US-20060079696-A1 Substituted compounds derived from N-(benzyl)phenylacetamide, preparation and uses GENFIT (FR) 2006-04-13 US disclosed
WO-2006035157-A2 SUBSTITUTED N-(BENZYL)PHENYLACETAMIDE DERIVATIVE COMPOUNDS, PREPARATION METHOD THEREOF AND USES OF SAME AS PPAR LIGANDS IN THE TREATMENT OF LIPID AND/OR GLUCIDIC DISORDERS GENFIT (FR) 2006-04-06 WO disclosed
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
US-4735959-A HYPOGLYCEMIC AGENTS DR. KARL THOMAE GMBH (DE) 1988-04-05 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-20060079696-A1 Substituted compounds derived from N-(benzyl)phenylacetamide, preparation and uses AADAC, NAT1, PARN KEAP1 714/4885GAA 433/4885MAPK1 3624/4885

“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.