SCHEMBL12646398

SCHEMBL12646398

O=C(O)CCc1ccc(-c2cccc(CO)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 13/20 0.69
▸ FFAR4 Q5NUL3 3/20 0.63
▸ AKR1B1 P15121 1/20 0.63
▸ KEAP1 Q14145 1/20 0.56
▸ ACMSD Q8TDX5 1/20 0.55
▸ LIPG Q9Y5X9 1/20 0.54
▸ MMP12 P39900 1/20 0.53
▸ PRKCI P41743 1/20 0.51
▸ RXRA P19793 1/20 0.51
▸ RXRB P28702 1/20 0.51
▸ RXRG P48443 1/20 0.51
▸ AKR1C3 P42330 1/20 0.51
▸ AKR1C2 P52895 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
SCHEMBL18563482 0.86 FFAR1 (0.67) FFAR1FFAR4AKR1B1KEAP1LIPG
SCHEMBL29381971 0.84 FFAR1 (0.69) FFAR1FFAR4AKR1B1KEAP1LIPG
SCHEMBL7347912 0.84 FFAR1 (0.69) FFAR1FFAR4AKR1B1KEAP1LIPG
SCHEMBL1744794 0.84 FFAR1 (0.85) FFAR1FFAR4AKR1B1
SCHEMBL25146744 0.84 FFAR1 (0.65) FFAR1FFAR4AKR1B1KEAP1LIPG
SCHEMBL9051375 0.83 FFAR1 (0.64) FFAR1FFAR4KEAP1
SCHEMBL23512360 0.83 FFAR1 (0.62) FFAR1FFAR4AKR1B1KEAP1LIPG
SCHEMBL8618654 0.82 FFAR1 (1.00) FFAR1FFAR4AKR1B1KEAP1MMP12
SCHEMBL1211561 0.82 FFAR1 (1.00) FFAR1FFAR4AKR1B1KEAP1MMP12
SCHEMBL18165305 0.82 FFAR1 (0.77) FFAR1FFAR4AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11008570-B2 3′ end caps for RNAi agents for use in RNA interference NOVARTIS AG (CH) 2021-05-18 — — US disclosed
EP-3722277-A2 3'END CAPS FOR RNA-INTERFERRING AGENTS FOR USE IN RNA Novartis AG (CH) 2020-10-14 — — EP disclosed
US-10227588-B2 3′end caps for RNAi agents for use in RNA interference NOVARTIS AG (CH) 2019-03-12 — — US disclosed
US-20160304863-A1 3'END CAPS FOR RNAi AGENTS FOR USE IN RNA INTERFERENCE NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH INC. 2016-10-20 — — US disclosed
US-20160304863-A1 3'END CAPS FOR RNAi AGENTS FOR USE IN RNA INTERFERENCE NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH INC. 2016-10-20 — — US disclosed
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET 2011-06-23 — — 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 (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-10227588-B2 3′end caps for RNAi agents for use in RNA interference RNGTT, NSUN2, NSUN3 FFAR1 4650/4885FFAR4 4785/4885AKR1B1 4233/4885
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES GPR119, INSR, GPR65 FFAR1 6/4885FFAR4 12/4885AKR1B1 141/4885
US-11008570-B2 3′ end caps for RNAi agents for use in RNA interference RNGTT, NSUN2, NSUN3 FFAR1 4650/4885FFAR4 4785/4885AKR1B1 4233/4885
US-20160304863-A1 3'END CAPS FOR RNAi AGENTS FOR USE IN RNA INTERFERENCE RNGTT, NSUN2, NSUN3 FFAR1 4656/4885FFAR4 4787/4885AKR1B1 4224/4885

“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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