SCHEMBL3435525

SCHEMBL3435525

CC(O)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
KMT2A Q03164 2/20 0.54
MAPK1 P28482 1/20 0.51
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
ELANE P08246 1/20 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
SCHEMBL17280822 1.00 ALDH1A1 (0.64) ALDH1A1KMT2AMAPK1CA12CA9
SCHEMBL6699242 1.00 ALDH1A1 (0.64) ALDH1A1KMT2AMAPK1CA12CA9
SCHEMBL12869027 0.85 ALDH1A1 (0.56) ALDH1A1KMT2AMAPK1CA12CA9
SCHEMBL4257901 0.84 CYP1B1 (0.62) ALDH1A1KMT2AMAPT
SCHEMBL9340887 0.83 ALDH1A1 (0.53) ALDH1A1KMT2AMAPK1CA12CA9
SCHEMBL30377710 0.83 ALDH1A1 (0.53) ALDH1A1KMT2ACA12CA9RAB9A
SCHEMBL5328150 0.83 ALDH1A1 (0.62) ALDH1A1KMT2AMAPK1CA12CA9
SCHEMBL8939993 0.83 ALDH1A1 (0.64) ALDH1A1KMT2AMAPK1CA12CA9
SCHEMBL4482770 0.83 ALDH1A1 (0.53) ALDH1A1KMT2ACA12CA9RAB9A
SCHEMBL28989527 0.82 ALDH1A1 (0.59) ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040087802-A1 Process for preparing glycidylphthalimide OSAKA SODA CO., LTD. (JP) 2004-05-06 US claimed
CN-115677511-B Synthesis method of 2, 2-difluoropropylamine hydrochloride 南通华祥医药科技有限公司 2024-06-21 CN disclosed
CN-115677511-A Synthetic method of2, 2-difluoropropylamine hydrochloride 南通华祥医药科技有限公司 2023-02-03 CN disclosed
CN-107540647-B -amino alkyl furan phenol ether and preparation method and application thereof 湖南大学 2020-11-24 CN disclosed
US-9873692-B2 Quinolinone-carboxamide compounds as 5-HT4 receptor agonists THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-01-23 US disclosed
US-9873692-B2 Quinolinone-carboxamide compounds as 5-HT4 receptor agonists THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-01-23 US disclosed
CN-107540647-A δ aminoalkyl furans phenolic ethers and preparation method and application 湖南大学 2018-01-05 CN disclosed
US-20170334901-A1 QUINOLINONE-CARBOXAMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-11-23 US disclosed
US-20170334901-A1 QUINOLINONE-CARBOXAMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-11-23 US disclosed
US-9771316-B2 Phenoxyalkylamine compound OSAKA UNIVERSITY (JP) 2017-09-26 US disclosed
US-20070270457-A1 Quinolinone-carboxamide compounds as 5-HT, receptor agonists ALFASIGMA S.P.A. (IT) 2007-11-22 US disclosed
US-20070270457-A1 Quinolinone-carboxamide compounds as 5-HT, receptor agonists ALFASIGMA S.P.A. (IT) 2007-11-22 US disclosed
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-07-12 US disclosed
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-06-14 US disclosed
WO-2005100350-A1 QUINOLINONE-CARBOXAMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS THERAVANCE, INC. (US) 2005-10-27 WO disclosed
EP-0790826-A4 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 1998-11-11 EP disclosed
CN-1173132-A Dihydropyrimidine compounds and application thereof SYNAPTIC PHARMACEUTIC CORP (US) 1998-02-11 CN disclosed
EP-0790826-A1 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-08-27 EP disclosed
EP-0629617-A1 Heteroatom-bearing ligands and metal complexes thereof BRACCO International B.V. (NL) 1994-12-21 EP disclosed
EP-0165110-A1 Optically active isocarbostyril derivatives and a method of preparing the same NISSHIN FLOUR MILLING CO., LTD. (JP) 1985-12-18 EP 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 (5 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-20070161685-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 ALDH1A1 2353/4885KMT2A 2236/4885MAPK1 3848/4885
US-20070270457-A1 Quinolinone-carboxamide compounds as 5-HT, receptor agonists HTR4, HTR5A, HTR1A ALDH1A1 2360/4885KMT2A 1436/4885MAPK1 2918/4885
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 ALDH1A1 2353/4885KMT2A 2236/4885MAPK1 3848/4885
US-20170334901-A1 QUINOLINONE-CARBOXAMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS HTR4, HTR5A, HTR1A ALDH1A1 2540/4885KMT2A 1511/4885MAPK1 2970/4885
US-20040087802-A1 Process for preparing glycidylphthalimide EZH1, ALKBH3, PHF2 ALDH1A1 1435/4885KMT2A 251/4885MAPK1 1899/4885

“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.