SCHEMBL6909147

SCHEMBL6909147

CCOC(=O)CNc1ccccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
THRB P10828 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PPID Q08752 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
LMNA P02545 2/20 0.46
ELANE P08246 1/20 0.46
HTT P42858 1/20 0.46
CDC25B P30305 1/20 0.46
GAA P10253 3/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46
HPGD P15428 2/20 0.44

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
SCHEMBL29926725 1.00 ALDH1A1 (0.49) ALDH1A1KDM4ETHRBTDP1PPID
SCHEMBL28665622 0.90 ALDH1A1 (0.50) ALDH1A1KDM4EPPIDCA12CA1
SCHEMBL28603994 0.87 THRB (0.49) ALDH1A1KDM4ETHRBTDP1LMNA
SCHEMBL5786263 0.85 GAA (0.54) ALDH1A1KDM4ETHRBTDP1PPID
SCHEMBL6902818 0.84 MAPT (0.45) ALDH1A1KDM4ETHRBTDP1CA12
SCHEMBL29926763 0.84 MAPT (0.45) ALDH1A1KDM4ETHRBTDP1CA12
SCHEMBL27886154 0.84 CYP1A2 (0.51) ALDH1A1CA12CA1CA2CA7
SCHEMBL7415643 0.83 ALDH1A1 (0.54) ALDH1A1KDM4ETHRBTDP1PPID
Hydrochloric Acid SCHEMBL8122459 0.83 GAA (0.53) ALDH1A1KDM4ETHRBTDP1PPID
Hydrochloric Acid SCHEMBL6990475 0.83 MAPT (0.44) ALDH1A1KDM4ETHRBTDP1CA12

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
US-6824786-B2 TOPICAL APPLYING COSMETIC YU RUEY J (US) 2004-11-30 US claimed
EP-1455734-A1 COMPOSITIONS COMPRISING PHENYL-GLYCINE DERIVATIVES Yu, Ruey J., Dr. (US) 2004-09-15 EP claimed
US-20030108496-A1 Compositions comprising phenyl-glycine derivatives YU RUEY J (US) 2003-06-12 US claimed
WO-2003045338-A1 COMPOSITIONS COMPRISING PHENYL-GLYCINE DERIVATIVES YU RUEY J (US) 2003-06-05 WO claimed
CN-112480020-B 2-substituted benzoxazole compound 东华理工大学 2023-10-10 CN disclosed
CN-113818033-B Electrochemical synthesis method of 2-substituted benzoxazole derivative 诚达药业股份有限公司 2022-10-14 CN disclosed
CN-113818033-A Electrochemical synthesis method of 2-substituted benzoxazole derivative 诚达药业股份有限公司 2021-12-21 CN disclosed
CN-112480020-A 2-substituted benzoxazole compound 东华理工大学 2021-03-12 CN disclosed
CN-108484670-B Synthetic method of phosphorus-containing benzoxazinone compounds 西北师范大学 2020-11-24 CN disclosed
US-6824786-B2 TOPICAL APPLYING COSMETIC YU RUEY J (US) 2004-11-30 US disclosed
EP-1455734-A1 COMPOSITIONS COMPRISING PHENYL-GLYCINE DERIVATIVES Yu, Ruey J., Dr. (US) 2004-09-15 EP disclosed
US-20030108496-A1 Compositions comprising phenyl-glycine derivatives YU RUEY J (US) 2003-06-12 US disclosed
WO-2003045338-A1 COMPOSITIONS COMPRISING PHENYL-GLYCINE DERIVATIVES YU RUEY J (US) 2003-06-05 WO 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-20030108496-A1 Compositions comprising phenyl-glycine derivatives GRHPR, ARL1, SUCLG1 ALDH1A1 1110/4885KDM4E 2760/4885THRB 1928/4885

“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.