SCHEMBL20501802

SCHEMBL20501802

COC(=O)C1CCC(CCC(=O)OC(C)(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.40
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.35
HPGD P15428 2/20 0.35
TSHR P16473 1/20 0.35
EPHX2 P34913 1/20 0.35
KLK7 P49862 1/20 0.33
ACHE P22303 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
NR1H2 P55055 1/20 0.33

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
SCHEMBL20501803 1.00 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL15626787 0.86 KMT2A (0.40) ALDH1A1KMT2AMEN1MAPTATM
SCHEMBL5789645 0.85 SMN1; SMN2 (0.41) ALDH1A1SMN1; SMN2KMT2AMEN1TP53
SCHEMBL5789642 0.85 SMN1; SMN2 (0.41) ALDH1A1SMN1; SMN2KMT2AMEN1TP53
SCHEMBL24072914 0.84 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL20501560 0.83 KMT2A (0.48) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL20501559 0.83 KMT2A (0.48) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL21805630 0.82 NR1H2 (0.36) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL21805629 0.82 NR1H2 (0.36) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL6657148 0.81 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2TP53GAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3609888-B1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF LILLY CO ELI (US) 2025-08-27 EP disclosed
EP-4596041-A2 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF Organovo, Inc. (US) 2025-08-06 EP disclosed
CN-110637015-B Fanisole X receptor agonist and application thereof 奥加诺沃公司 2024-04-02 CN disclosed
US-20220089575-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF ORGANOVO, INC. 2022-03-24 US disclosed
US-20220054469-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF METACRINE, INC. 2022-02-24 US disclosed
US-11236071-B1 Farnesoid X receptor agonists and uses thereof METACRINE, INC. (US) 2022-02-01 US disclosed
CN-113056264-A Farnesoin X receptor agonists and uses thereof 梅塔科林公司 2021-06-29 CN disclosed
EP-3609888-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF Metacrine, Inc. (US) 2020-02-19 EP disclosed
CN-110637015-A Farnesoin X receptor agonists and uses thereof 梅塔科林公司 2019-12-31 CN disclosed
WO-2018170182-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF METACRINE, INC. (US) 2018-09-20 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 (3 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-20220054469-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF NR1H4, NR1H2, NR1H3 ALDH1A1 2205/4885SMN1; SMN2 4590/4885KMT2A 4719/4885
US-20220089575-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF NR1H4, NR1H2, NR1H3 ALDH1A1 2205/4885SMN1; SMN2 4590/4885KMT2A 4719/4885
US-11236071-B1 Farnesoid X receptor agonists and uses thereof NR1H4, NR1H2, NR1H3 ALDH1A1 2205/4885SMN1; SMN2 4590/4885KMT2A 4719/4885

“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.