SCHEMBL3754394

SCHEMBL3754394

CC(C)(N)CC(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.52
KMT2A Q03164 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
CYP3A4 P08684 3/20 0.52
MAPK1 P28482 2/20 0.52
MEN1 O00255 2/20 0.52
HPGD P15428 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALOX15 P16050 1/20 0.52
CES1 P23141 1/20 0.52
ALDH1A1 P00352 4/20 0.48
HIF1A Q16665 3/20 0.48
GSK3B P49841 2/20 0.48
PTPN1 P18031 2/20 0.48
TRPA1 O75762 1/20 0.48
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
L3MBTL1 Q9Y468 4/20 0.47
LMNA P02545 2/20 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
SCHEMBL19619388 1.00 MAPT (0.52) MAPTKMT2ATDP1CYP3A4MAPK1
Hydrochloric Acid SCHEMBL10431496 0.98 MAPT (0.50) MAPTKMT2ATDP1CYP3A4MAPK1
SCHEMBL3242580 0.83 MAPT (0.56) MAPTKMT2ATDP1CYP3A4MAPK1
SCHEMBL23064499 0.82 MAPT (0.50) MAPTKMT2ATDP1CYP3A4MAPK1
SCHEMBL95591 0.81 KMT2A (0.54) MAPTKMT2ATDP1CYP3A4MAPK1
SCHEMBL95590 0.81 MAPT (0.54) MAPTKMT2ATDP1CYP3A4MAPK1
SCHEMBL379725 0.81 KMT2A (0.54) MAPTKMT2ATDP1CYP3A4MAPK1
SCHEMBL7793888 0.80 MAPT (0.33) MAPTKMT2ATDP1CYP3A4MAPK1
SCHEMBL11115633 0.80 NPC1 (0.52) MAPTKMT2AMEN1HPGDSMN1; SMN2
Methylamine SCHEMBL13837152 0.80 MAPT (0.48) MAPTKMT2ATDP1CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213254-B Beta-nitroketone and preparation method and application method thereof 北京师范大学 2023-04-25 CN disclosed
CN-114213254-A Beta-nitroketone, and preparation method and application method thereof 北京师范大学 2022-03-22 CN disclosed
CN-109143778-A Resin combination, cured film, the manufacturing method of colour filter and cured film 东京应化工业株式会社 2019-01-04 CN disclosed
CN-108957956-A Solidification compound, solidfied material, cured film, the manufacturing method of display panel and solidfied material 东京应化工业株式会社 2018-12-07 CN disclosed
US-20100292289-A1 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES AMPLA PHARMACEUTICALS INC. (US) 2010-11-18 US disclosed
US-20100292289-A1 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES AMPLA PHARMACEUTICALS INC. (US) 2010-11-18 US disclosed
US-20100292289-A1 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES AMPLA PHARMACEUTICALS INC. (US) 2010-11-18 US disclosed
WO-2009073138-A2 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES AMPLA PHARMACEUTICALS INC. (US) 2009-06-11 WO disclosed
EP-0153890-A2 Derivatives of 3-phenyl-2-propenamine, their preparation and medicines containing them RHONE-POULENC SANTE (FR) 1985-09-04 EP disclosed
US-4273851-A Method of coating using photopolymerizable latex systems RICHARDSON GRAPHICS COMPANY (US) 1981-06-16 US disclosed
US-4224398-A Photopolymerizable latex systems RICHARDSON GRAPHICS COMPANY (US) 1980-09-23 US disclosed
US-4186069-A PARTICLES OF WATER-INSOLUBLE POLYMERS IN COMBINATION WITH WATER-SOLUBLE, LIGHT-SENSITIVE POLYMERS RICHARDSON GRAPHICS COMPANY (US) 1980-01-29 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-20100292289-A1 TREATMENT OF METABOLIC SYNDROME WITH NOVEL AMIDES GPR119, CPT1A, GLS2 MAPT 3155/4885KMT2A 1826/4885TDP1 4666/4885

“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.