SCHEMBL5370866

SCHEMBL5370866

COC(=O)C(CC(C)S)NC(=O)CCc1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.49
▸ TAS1R3 Q7RTX0 1/20 0.46
▸ TAS1R1 Q7RTX1 1/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ MDM4 O15151 1/20 0.46
▸ MDM2 Q00987 1/20 0.46
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ LNPEP Q9UIQ6 1/20 0.43
▸ HDAC1 Q13547 3/20 0.42
▸ HDAC6 Q9UBN7 3/20 0.42
▸ ESR1 P03372 1/20 0.42
▸ ESR2 Q92731 1/20 0.42
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 1/20 0.41

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
SCHEMBL1856571 0.84 MDM4 (0.62) ALDH1A1NPSR1MDM4MDM2TSHR
SCHEMBL4152603 0.84 MDM4 (0.62) ALDH1A1NPSR1MDM4MDM2TSHR
SCHEMBL4153061 0.80 MDM4 (0.67) ALDH1A1NPSR1MDM4MDM2TSHR
SCHEMBL4149824 0.80 MDM4 (0.67) ALDH1A1NPSR1MDM4MDM2TSHR
SCHEMBL4149820 0.80 MDM4 (0.67) ALDH1A1NPSR1MDM4MDM2TSHR
SCHEMBL4153058 0.80 MDM4 (0.67) ALDH1A1NPSR1MDM4MDM2TSHR
SCHEMBL5381881 0.79 ALDH1A1 (0.54) ALDH1A1HDAC2HDAC8ESR1ESR2
SCHEMBL5370183 0.79 L3MBTL1 (0.56) ALDH1A1TAS1R3TAS1R1KMT2A
SCHEMBL5371472 0.77 TAS1R3 (0.52) ALDH1A1TAS1R3TAS1R1
SCHEMBL13602582 0.76 ALDH1A1 (0.69) ALDH1A1HDAC2HDAC8TSHRESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223793-B2 Phenolic acid derivatives and composition for preventing or treating blood lipid level-related diseases comprising the same BIONUTRIGEN CO., LTD. (KR) 2007-05-29 — — US disclosed
US-20030199566-A1 Phenolic acid derivatives and composition for preventing or treating blood lipid level-related diseases comprising the same BIONUTRIGEN CO., LTD. (KR) 2003-10-23 — — US 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-20030199566-A1 Phenolic acid derivatives and composition for preventing or treating blood lipid level-related diseases comprising the same NCEH1, HMGCR, DBH ALDH1A1 498/4885TAS1R3 1647/4885TAS1R1 1429/4885

“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.

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