SCHEMBL5789645

SCHEMBL5789645

COC(=O)[C@H]1CC[C@H](CC(=O)OC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 4/20 0.38
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.36
MEN1 O00255 2/20 0.35
TSHR P16473 1/20 0.35
BRD4 O60885 2/20 0.34
HRH3 Q9Y5N1 1/20 0.33
NR1H2 P55055 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
HPGD P15428 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 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
SCHEMBL5789642 1.00 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1KMT2ATP53GAA
SCHEMBL26964551 0.90 KMT2A (0.36) SMN1; SMN2ALDH1A1KMT2ATP53MEN1
SCHEMBL1932287 0.86 NR1H2 (0.41) SMN1; SMN2ALDH1A1KMT2ABRD4NR1H2
SCHEMBL20501802 0.85 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1KMT2ATP53GAA
SCHEMBL20501803 0.85 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1KMT2ATP53GAA
SCHEMBL28468627 0.84 BRD4 (0.42) SMN1; SMN2ALDH1A1KMT2ATP53GAA
SCHEMBL173945 0.84 ALDH1A1 (0.48) ALDH1A1KMT2AGAAMEN1TSHR
SCHEMBL174440 0.83 KMT2A (0.49) SMN1; SMN2ALDH1A1KMT2AMEN1TSHR
SCHEMBL5793678 0.83 KMT2A (0.49) SMN1; SMN2ALDH1A1KMT2AMEN1TSHR
SCHEMBL1001604 0.82 NR1H2 (0.37) SMN1; SMN2ALDH1A1KMT2AMEN1TSHR

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 17 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-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-01-25 US disclosed
US-20230142629-A1 BIFUNCTIONAL DEGRADERS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES AND THERAPEUTIC USE THEREOF GILEAD SCIENCES, INC. 2023-05-11 US 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
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
WO-2020061112-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF METACRINE, INC. (US) 2020-03-26 WO 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
US-20170197960-A1 ATX MODULATING AGENTS BIOGEN MA INC. 2017-07-13 US disclosed
WO-2006009819-A1 INHIBITORS OF CHOLESTERYL ESTER TRANSFER PROTIEN ARRAY BIOPHARMA INC. (US) 2006-01-26 WO disclosed
US-20050282812-A1 Inhibitors of cholesteryl ester transfer protein ARRAY BIOPHARMA INC. 2005-12-22 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 (7 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 SMN1; SMN2 4590/4885ALDH1A1 2205/4885KMT2A 4719/4885
US-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF MDM2, TP53, MDM4 SMN1; SMN2 3149/4885ALDH1A1 1804/4885KMT2A 1193/4885
US-20220089575-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF NR1H4, NR1H2, NR1H3 SMN1; SMN2 4590/4885ALDH1A1 2205/4885KMT2A 4719/4885
US-20170197960-A1 ATX MODULATING AGENTS ENPP2, ATXN10, ATXN2 SMN1; SMN2 119/4885ALDH1A1 4081/4885KMT2A 1485/4885
US-20230142629-A1 BIFUNCTIONAL DEGRADERS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES AND THERAPEUTIC USE THEREOF IRAK1, IRAK2, IRAK4 SMN1; SMN2 1220/4885ALDH1A1 1632/4885KMT2A 1154/4885
US-11236071-B1 Farnesoid X receptor agonists and uses thereof NR1H4, NR1H2, NR1H3 SMN1; SMN2 4590/4885ALDH1A1 2205/4885KMT2A 4719/4885
US-20050282812-A1 Inhibitors of cholesteryl ester transfer protein CETP, LCAT, MTTP SMN1; SMN2 4861/4885ALDH1A1 2949/4885KMT2A 3678/4885

“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.