SCHEMBL553054

SCHEMBL553054

CC(C)(C)CC(=O)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.36
CHRM1 P11229 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD11B1 P28845 1/20 0.32
KDM4E B2RXH2 1/20 0.31
FFAR1 O14842 1/20 0.31
CPT2 P23786 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MIF P14174 1/20 0.31
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL23424122 0.80 HMGCR (0.36) HMGCRCHRM1TBXA2RADRA1AKMT2A
SCHEMBL13543290 0.78 HMGCR (0.41) HMGCRCHRM1TBXA2RADRA1AKMT2A
SCHEMBL8460026 0.77 HMGCR (0.31) HMGCRCHRM1TBXA2RADRA1A
SCHEMBL13554238 0.75 HMGCR (0.33) HMGCRCHRM1TBXA2RADRA1ATSHR
SCHEMBL11993633 0.75 KMT2A (0.33) HMGCRCHRM1TBXA2RADRA1AKMT2A
SCHEMBL25007292 0.75 FAAH (0.42) KMT2A
SCHEMBL8406316 0.75 KMT2A (0.33) HMGCRCHRM1TBXA2RADRA1AKMT2A
SCHEMBL8962260 0.75 HMGCR (0.33) HMGCRCHRM1TBXA2RADRA1AKMT2A
SCHEMBL2905419 0.73 TSHR (0.42) HMGCRCHRM1TBXA2RADRA1AKMT2A
SCHEMBL20428537 0.73 HMGCR (0.32) HMGCRCHRM1TBXA2RADRA1ATSHR

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 332 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024256780-A1 COMPOSITION COMPRISING PVDF AND USE THEREOF FOR PREPARING AN ELECTRODE ARKEMA FRANCE (FR) 2024-12-19 WO disclosed
WO-2024149954-A1 COMPOSITION FOR ALL-SOLID-STATE BATTERY, AND FILM PREPARED THEREFROM ARKEMA FRANCE (FR) 2024-07-18 WO disclosed
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 US disclosed
US-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF FIREFLY BIO, INC. 2024-07-04 US disclosed
US-12019371-B2 Photosensitive composition, film, color filter, solid-state imaging element, and image display device FUJIFILM CORPORATION (JP) 2024-06-25 US disclosed
US-12016903-B2 Long-acting growth hormone treatment ASCENDIS PHARMA ENDOCRINOLOGY DIVISION A/S (DK) 2024-06-25 US disclosed
WO-2024110734-A1 METHOD FOR PREPARING A HALOGENATED POLYMER VIA DEHYDROHALOGENATION ARKEMA FRANCE (FR) 2024-05-30 WO disclosed
US-20240066141-A1 LINKERS, CONJUGATES AND APPLICATIONS THEREOF GENEQUANTUM HEALTHCARE (SUZHOU) CO., LTD. (CN) 2024-02-29 US disclosed
US-20240067640-A1 PHENYL MALEIMIDE LINKER AGENTS FIREFLY BIO, INC. 2024-02-29 US disclosed
US-20240024494-A1 SMALL-MOLECULE CONJUGATE AND USE THEREOF ANHUI CHINA RESOURCES JINCHAN PHARMACEUTICAL CO., LTD. (CN) 2024-01-25 US disclosed
US-7342016-B2 Farnesyl protein transferase inhibitors as antitumor agents SCHERING CORPORATION (US) 2008-03-11 US disclosed
US-7291618-B2 Therapeutic compounds PFIZER INC (US) 2007-11-06 US disclosed
US-20070213315-A1 Modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED 2007-09-13 US disclosed
US-20070161664-A1 THERAPEUTIC COMPOUNDS PFIZER INC 2007-07-12 US disclosed
US-20070099897-A1 Therapeutic compounds PFIZER INC 2007-05-03 US disclosed
US-7199265-B2 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones KARO BIO AB (SE) 2007-04-03 US disclosed
US-7192979-B2 EP4 receptor selective agonist in the treatment of osteoporosis PFIZER INC. (US) 2007-03-20 US disclosed
US-20070054837-A1 Bicyclic lactones, perfumery uses thereof, processes for preparing same and intermediates therefor INTERNATIONAL FLAVORS & FRAGRANCES INC. 2007-03-08 US disclosed
US-20070032437-A1 that bind cellular inhibitor of apoptosis proteins; drug design and development for diagnosis, prevention and treatment of cell proliferative disease; anticarcinogenic agents THE TRUSTEES OF PRINCETON UNIVERSITY 2007-02-08 US disclosed
US-7169747-B2 Bicyclic lactones, perfumery uses thereof, processes for preparing same and intermediates therefor INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2007-01-30 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 (10 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-20070099897-A1 Therapeutic compounds SLC5A2, SLC5A1, REN HMGCR 328/4885CHRM1 988/4885TBXA2R 74/4885
US-20070213315-A1 Modulators of muscarinic receptors CHRM3, CHRM5, CHRM2 HMGCR 686/4885CHRM1 6/4885TBXA2R 48/4885
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 HMGCR 3590/4885CHRM1 4416/4885TBXA2R 4429/4885
US-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF NR3C1, NR3C2, MC2R HMGCR 978/4885CHRM1 1642/4885TBXA2R 165/4885
US-12016903-B2 Long-acting growth hormone treatment GHRHR, GHSR, GHITM HMGCR 379/4885CHRM1 4855/4885TBXA2R 2213/4885
US-20240066141-A1 LINKERS, CONJUGATES AND APPLICATIONS THEREOF CD44, EPCAM, MSN HMGCR 2201/4885CHRM1 2645/4885TBXA2R 2515/4885
US-20070161664-A1 THERAPEUTIC COMPOUNDS SLC5A2, SLC5A1, REN HMGCR 328/4885CHRM1 988/4885TBXA2R 74/4885
US-20070032437-A1 that bind cellular inhibitor of apoptosis proteins; drug design and development for diagnosis, prevention and treatment of cell proliferative disease; anticarcinogenic agents BIRC3, API5, BID HMGCR 3532/4885CHRM1 4333/4885TBXA2R 3831/4885
US-20240067640-A1 PHENYL MALEIMIDE LINKER AGENTS TPX2, H1-4, MAPT HMGCR 3765/4885CHRM1 39/4885TBXA2R 3578/4885
US-20240024494-A1 SMALL-MOLECULE CONJUGATE AND USE THEREOF SLC7A5, SLC43A1, CD44 HMGCR 1651/4885CHRM1 4164/4885TBXA2R 2639/4885

“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.