SCHEMBL28850353

SCHEMBL28850353

CCCCOC(=O)[C@@](C)(N)Cc1ccc(O)c(O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.61
CYP3A4 P08684 3/20 0.61
KDM4E B2RXH2 2/20 0.61
ALDH1A1 P00352 2/20 0.61
POLB P06746 2/20 0.61
MAPT P10636 2/20 0.61
HPGD P15428 2/20 0.61
ALOX15 P16050 2/20 0.61
HSD17B10 Q99714 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
MEN1 O00255 1/20 0.61
USP2 O75604 1/20 0.61
EGFR P00533 1/20 0.61
FYN P06241 1/20 0.61
GAA P10253 1/20 0.61
APEX1 P27695 1/20 0.61
ADRA1A P35348 1/20 0.61
PTGS2 P35354 1/20 0.61
MTOR P42345 1/20 0.61
RECQL P46063 1/20 0.61

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
SCHEMBL24761596 1.00 CYP1A2 (0.61) CYP1A2CYP3A4KDM4EALDH1A1POLB
SCHEMBL29881538 0.92 KDM4E (0.64) CYP1A2CYP3A4KDM4EALDH1A1POLB
SCHEMBL24761068 0.92 KDM4E (0.64) CYP1A2CYP3A4KDM4EALDH1A1POLB
Methyldopate SCHEMBL29587132 0.87 HSD17B10 (0.66) CYP1A2CYP3A4KDM4EALDH1A1POLB
Methyldopate SCHEMBL297359 0.87 HSD17B10 (0.66) CYP1A2CYP3A4KDM4EALDH1A1POLB
Methyldopate SCHEMBL11430187 0.87 HSD17B10 (0.66) CYP1A2CYP3A4KDM4EALDH1A1POLB
SCHEMBL11509446 0.87 MAPT (0.52) CYP1A2CYP3A4KDM4EALDH1A1POLB
SCHEMBL11850560 0.86 KDM4E (0.61) CYP1A2CYP3A4KDM4EALDH1A1POLB
Hydrochloric Acid SCHEMBL11454988 0.86 KDM4E (0.61) CYP1A2CYP3A4KDM4EALDH1A1POLB
SCHEMBL11447165 0.86 KDM4E (0.61) CYP1A2CYP3A4KDM4EALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230109489-A1 Compound and Use Thereof FELIQS CORPORATION (JP) 2023-04-06 US disclosed
EP-4101839-A1 COMPOUND AND USE THEREOF Feliqs Corporation (JP) 2022-12-14 EP disclosed
CN-115103832-A Compound and use thereof 株式会社费利克斯 2022-09-23 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-20230109489-A1 Compound and Use Thereof LPO, GPX4, ALOX15 CYP1A2 1164/4885CYP3A4 222/4885KDM4E 2199/4885

“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.