SCHEMBL1201437

SCHEMBL1201437

NC(=O)CC(=O)c1cccs1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.65
FEN1 P39748 1/20 0.65
RAB9A P51151 4/20 0.64
ALDH1A1 P00352 4/20 0.64
NPC1 O15118 3/20 0.64
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
LMNA P02545 2/20 0.64
POLB P06746 2/20 0.64
GSK3B P49841 1/20 0.60
HPGD P15428 5/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
HDAC1 Q13547 2/20 0.53
DAO P14920 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.51
PKM P14618 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51

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
SCHEMBL711360 0.87 RAB9A (0.75) ERCC5FEN1RAB9AALDH1A1NPC1
SCHEMBL5188799 0.82 ALDH1A1 (0.81) ERCC5FEN1RAB9AALDH1A1NPC1
SCHEMBL4341460 0.82 ERCC5 (0.72) ERCC5FEN1RAB9AALDH1A1NPC1
SCHEMBL1476817 0.81 KMT2A (0.71) ERCC5FEN1RAB9AALDH1A1NPC1
SCHEMBL1547840 0.80 ERCC5 (0.65) ERCC5FEN1RAB9AALDH1A1NPC1
SCHEMBL355263 0.79
SCHEMBL4765892 0.79
SCHEMBL2216212 0.79 ALDH1A1 (1.00) ERCC5FEN1RAB9AALDH1A1NPC1
SCHEMBL31291382 0.78 ERCC5 (1.00) ERCC5FEN1RAB9AALDH1A1NPC1
SCHEMBL28459884 0.78 ERCC5 (0.62) ERCC5FEN1RAB9AALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0751427-B1 Image-dye-forming couplers and photographic elements containing them EASTMAN KODAK CO (US) 2001-03-28 EP claimed
EP-0751427-A1 Image-dye-forming couplers and photographic elements containing them KODAK LIMITED (GB) 1997-01-02 EP claimed
CN-102321066-B Method for producing aryl-aminopropanols SALTIGO GMBH 2014-07-23 CN disclosed
US-8293899-B2 Ketone transfer hydrogenation of stereoisomerically enriched 3-heteroaryl-3-oxocarboxylic esters by reducing 3-heteroaryl-3-hydroxycarboxylic esters in the presence of a ruthenium-containing catalyst, an amine and formic acid and/or formates LANXESS DEUTSCHLAND GMBH (DE) 2012-10-23 US disclosed
CN-1445224-B Process for preparing arylaminopropanols SALTIGO GMBH 2012-07-11 CN disclosed
CN-102321066-A The method for preparing the arylamino propyl alcohol SALTIGO GMBH 2012-01-18 CN disclosed
US-7893281-B2 Process for preparing arylaminopropanols LANXESS DEUTSCHLAND GMBH (DE) 2011-02-22 US disclosed
US-20090286997-A1 PROCESS FOR PREPARING ARYLAMINOPROPANOLS LANXESS DEUTSCHLAND GMBH (DE) 2009-11-19 US disclosed
US-7582776-B2 Process for preparing arylaminopropanols LANXESS DEUTSCHLAND GMBH (DE) 2009-09-01 US disclosed
EP-1346977-B1 Method for producing aryl-aminopropanols SALTIGO GMBH (DE) 2009-07-22 EP disclosed
US-20080262247-A1 Process for preparing arylaminopropanols ECKERT MARKUS 2008-10-23 US disclosed
US-20030225153-A1 Process for preparing arylaminopropanols LANXESS DEUTSCHLAND GMBH (DE) 2003-12-04 US disclosed
US-20030225274-A1 Process for reducing 3-heteroaryl-3-oxopropionic acid derivatives LANXESS DEUTSCHLAND GMBH (DE) 2003-12-04 US disclosed
CN-1445224-A Process for preparing arylaminopropanols BAYER AG (DE) 2003-10-01 CN disclosed
EP-1346977-A1 Method for producing aryl-aminopropanols Bayer Aktiengesellschaft (DE) 2003-09-24 EP disclosed
EP-1340746-A1 Process for the reduction of 3-heteroaryl-3-oxo-propanoic acid derivatives BAYER AG (DE) 2003-09-03 EP disclosed
EP-0751427-B1 Image-dye-forming couplers and photographic elements containing them EASTMAN KODAK CO (US) 2001-03-28 EP disclosed
US-5919969-A MALONAMIDES EASTMAN KODAK COMPANY (US) 1999-07-06 US disclosed
EP-0751427-A1 Image-dye-forming couplers and photographic elements containing them KODAK LIMITED (GB) 1997-01-02 EP disclosed
EP-0751427-A1 Image-dye-forming couplers and photographic elements containing them KODAK LIMITED (GB) 1997-01-02 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 (4 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-20030225153-A1 Process for preparing arylaminopropanols AHR, CYP1A1, CYP1A2 ERCC5 2879/4885FEN1 1941/4885RAB9A 3297/4885
US-20090286997-A1 PROCESS FOR PREPARING ARYLAMINOPROPANOLS AHR, CYP1A1, CYP1A2 ERCC5 2879/4885FEN1 1941/4885RAB9A 3297/4885
US-20080262247-A1 Process for preparing arylaminopropanols CYP1A1, CYP1A2, AHR ERCC5 2967/4885FEN1 1728/4885RAB9A 3050/4885
US-20030225274-A1 Process for reducing 3-heteroaryl-3-oxopropionic acid derivatives GRHPR, HPD, HAAO ERCC5 1067/4885FEN1 1305/4885RAB9A 3428/4885

“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.