SCHEMBL5370663

SCHEMBL5370663

O=C(O)CN(OCc1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TDP1 Q9NUW8 2/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KMT2A Q03164 1/20 0.42
AKR1B1 P15121 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
MAOB P27338 1/20 0.40
KEAP1 Q14145 5/20 0.40
NFE2L2 Q16236 4/20 0.40
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
TSHR P16473 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 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
SCHEMBL8314741 0.89 RXRA (0.49) ALDH1A1HPGDNPC1RAB9A
SCHEMBL8310205 0.83 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1MAPTHPGD
SCHEMBL11133454 0.83 HTT (0.45) ALDH1A1MAPK1SLC6A3KEAP1FFAR1
SCHEMBL27576865 0.80 ALDH1A1 (0.44) ALDH1A1TDP1L3MBTL1KMT2ATSHR
SCHEMBL7587208 0.79 ALDH1A1 (0.47) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL27739393 0.78 ALDH1A1 (0.46) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL6271777 0.78 ALDH1A1 (0.46) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL22321972 0.78 TSHR (0.41) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL5310161 0.77 TSHR (0.44) ALDH1A1TDP1MAPK1L3MBTL1KMT2A
SCHEMBL11330873 0.76 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023227734-A1 FLAVIVIRUS INHIBITORS IRBM S.P.A. (IT) 2023-11-30 WO disclosed
EP-4282862-A1 FLAVIVIRUS INHIBITORS IRBM S.P.A. (IT) 2023-11-29 EP disclosed
CN-101353312-B Phenylglycine derivatives synthesis HENGDIAN GROUP JIAYUAN CHEMICAL INDUSTRY CO., LTD. (CN) 2011-12-14 CN disclosed
CN-101353312-A Phenylglycine derivatives synthesis HENGDIAN GROUP JIAYUAN CHEMIST (CN) 2009-01-28 CN disclosed
WO-2007008942-A2 PHENYLAMINO-ACETIC ACID [1-(PYRIDIN-4-YL)-METHYLIDENE]-HYDRAZIDE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF G PROTEIN-COUPLED RECEPTOR KINASES FOR THE TREATMENT OF EYE DISEASES AERIE PHARMACEUTICALS, INC. (US) 2007-01-18 WO disclosed
US-6620823-B2 Antiinflammatory agents; rheumatic disorders BRISTOL-MYERS SQUIBB PHARME COMPANY 2003-09-16 US disclosed
EP-1299379-A2 LACTAM METALLOPROTEASE INHIBITORS Bristol-Myers Squibb Pharma Company (US) 2003-04-09 EP disclosed
US-20020042398-A1 Novel lactam metalloprotease inhibitors BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-04-11 US disclosed
WO-2002004416-A2 LACTAM METALLOPROTEASE INHIBITORS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-01-17 WO disclosed
CN-1057296-C Morpholine tachykinin receptor antagonists, their preparation and use MERCK & CO INC (US) 2000-10-11 CN disclosed
EP-0934262-A1 BETA-THIOPROPIONYL-AMINO ACID DERIVATIVES AND THEIR USE AS BETA-LACTAMASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 1999-08-11 EP disclosed
WO-1998017639-A1 BETA-THIOPROPIONYL-AMINO ACID DERIVATIVES AND THEIR USE AS BETA-LACTAMASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 1998-04-30 WO disclosed
CN-1142819-A Morpholine and thiomorpholine tachykinin receptor antagonists MERCK & CO INC (US) 1997-02-12 CN 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-20020042398-A1 Novel lactam metalloprotease inhibitors ADAM9, ADAM8, ADAM17 ALDH1A1 1477/4885TDP1 2834/4885MAPK1 2685/4885

“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.