SCHEMBL174440

SCHEMBL174440

CC(C)(C)OC(=O)CC1CCC(C(=O)O)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.49
LMNA P02545 2/20 0.46
PLG P00747 1/20 0.46
PLAT P00750 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
BTK Q06187 1/20 0.41
HSD17B10 Q99714 1/20 0.38
ANPEP P15144 1/20 0.38
ENPEP Q07075 1/20 0.38
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
NR1H2 P55055 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP2C9 P11712 1/20 0.33
LIPA P38571 1/20 0.33
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32

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
SCHEMBL5793678 1.00 KMT2A (0.49) KMT2ALMNAPLGPLATSMN1; SMN2
SCHEMBL1932287 0.89 NR1H2 (0.41) KMT2ASMN1; SMN2THRATHRBNR1H2
SCHEMBL20501560 0.84 KMT2A (0.48) KMT2ALMNAPLGPLATSMN1; SMN2
SCHEMBL20501559 0.84 KMT2A (0.48) KMT2ALMNAPLGPLATSMN1; SMN2
SCHEMBL21887572 0.84 NR1H2 (0.37) KMT2ASMN1; SMN2BTKTHRATHRB
SCHEMBL28339790 0.84 NR1H2 (0.37) KMT2ASMN1; SMN2BTKTHRATHRB
SCHEMBL10281225 0.84 SMN1; SMN2 (0.37) KMT2ALMNAPLGPLATSMN1; SMN2
SCHEMBL17391169 0.84 BTK (0.41) KMT2ALMNAPLGPLATSMN1; SMN2
SCHEMBL5006287 0.84 BTK (0.41) KMT2ALMNAPLGPLATSMN1; SMN2
SCHEMBL5006289 0.84 BTK (0.41) KMT2ALMNAPLGPLATSMN1; SMN2

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 22 patents — showing the first 20. 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-114736168-B Isoxazoline derivative containing tranexamic acid fragment and preparation and application thereof 沈阳中化农药化工研发有限公司 2024-08-09 CN disclosed
CN-115304606-B Degradation agent for simultaneously targeting BTK and GSPT proteins 清华大学 2024-04-19 CN disclosed
CN-110637015-B Fanisole X receptor agonist and application thereof 奥加诺沃公司 2024-04-02 CN disclosed
CN-114736168-A Isoxazoline derivative containing tranexamic acid fragment and preparation and application thereof 沈阳中化农药化工研发有限公司 2022-07-12 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
EP-3852737-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF Metacrine, Inc. (US) 2021-07-28 EP 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
EP-3092229-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS Bristol-Myers Squibb Company (US) 2016-11-16 EP disclosed
WO-2015103509-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-07-09 WO disclosed
EP-2611783-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-07-10 EP disclosed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 US disclosed
WO-2012029032-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-03-08 WO 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 (5 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 KMT2A 4719/4885LMNA 1148/4885PLG 2817/4885
US-20220089575-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF NR1H4, NR1H2, NR1H3 KMT2A 4719/4885LMNA 1148/4885PLG 2817/4885
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS DGAT1, DGAT2, SOAT1 KMT2A 2187/4885LMNA 2076/4885PLG 3331/4885
US-11236071-B1 Farnesoid X receptor agonists and uses thereof NR1H4, NR1H2, NR1H3 KMT2A 4719/4885LMNA 1148/4885PLG 2817/4885
US-20050282812-A1 Inhibitors of cholesteryl ester transfer protein CETP, LCAT, MTTP KMT2A 3678/4885LMNA 1504/4885PLG 1001/4885

“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.