SCHEMBL29972770

SCHEMBL29972770

Cc1cc(C)n(CCCCCC[S+]([O-])c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)n1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 6/20 0.63
ACAT1 P24752 1/20 0.63
KDM4E B2RXH2 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CASP3 P42574 1/20 0.36
HTT P42858 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL3378259 1.00 SOAT1 (0.63) SOAT1ACAT1KDM4ESMN1; SMN2HPGD
SCHEMBL9565792 1.00 SOAT1 (0.63) SOAT1ACAT1KDM4ESMN1; SMN2HPGD
SCHEMBL9597124 0.87 SOAT1 (0.48) SOAT1ACAT1
SCHEMBL9525341 0.86 SOAT1 (0.47) SOAT1ACAT1
SCHEMBL9201449 0.77 SOAT1 (1.00) SOAT1ACAT1
SCHEMBL3379092 0.77 SOAT1 (1.00) SOAT1ACAT1
Hydrochloric Acid SCHEMBL9212683 0.76 SOAT1 (0.98) SOAT1ACAT1
SCHEMBL9213110 0.76 SOAT1 (0.98) SOAT1ACAT1
SCHEMBL9202439 0.76 SOAT1 (0.63) SOAT1ACAT1KDM4ESMN1; SMN2HPGD
SCHEMBL7640471 0.75 KDM4E (0.36) SOAT1ACAT1KDM4ESMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11911469-B2 Combination of ACAT1 inhibitor and checkpoint antibody for treating cancer Center for Excellence in Molecular Cell Science, Chinese Academy of Scienes (CN) 2024-02-27 US claimed
US-11571400-B2 ACAT1 inhibitors for treating cancer CENTER FOR EXCELLENCE IN MOLECULAR CELL SCIENCE, CHINESE ACADEMY OF SCIENCES (CN) 2023-02-07 US claimed
EP-4525833-A2 VETERINARY PHARMACEUTICAL FORMULATIONS Increvet, Inc. (US) 2025-03-26 EP disclosed
CN-118307452-A Synthesis method of chiral alkylaryl sulfoxide 南京工业大学 2024-07-09 CN disclosed
CN-118076367-A GLP-1 receptor agonists with improved pharmacological and drug delivery properties 达比克斯有限责任公司 2024-05-24 CN disclosed
US-11911469-B2 Combination of ACAT1 inhibitor and checkpoint antibody for treating cancer Center for Excellence in Molecular Cell Science, Chinese Academy of Scienes (CN) 2024-02-27 US disclosed
WO-2023225492-A2 VETERINARY PHARMACEUTICAL FORMULATIONS INCREVET, INC. (US) 2023-11-23 WO disclosed
WO-2023220930-A1 VETERINARY PHARMACEUTICAL FORMULATIONS CROSS-REFERENCES TO RELATED APPLICATIONS INCREVET, INC. (US) 2023-11-23 WO disclosed
US-20230372374-A1 VETERINARY PHARMACEUTICAL FORMULATIONS INCREVET, INC. 2023-11-23 US disclosed
US-20230132366-A9 METHODS FOR TREATING DYSREGULATED LIPID METABOLISM DENALI THERAPEUTICS INC. (US) 2023-04-27 US disclosed
US-11571400-B2 ACAT1 inhibitors for treating cancer CENTER FOR EXCELLENCE IN MOLECULAR CELL SCIENCE, CHINESE ACADEMY OF SCIENCES (CN) 2023-02-07 US disclosed
US-20230000917-A1 TREATMENT OF HEPATITIS B VIRUS (HBV) INFECTION UCL BUSINESS LTD (GB) 2023-01-05 US disclosed
EP-4065170-A1 TREATMENT OF HEPATITIS B VIRUS (HBV) INFECTION UCL Business Ltd (GB) 2022-10-05 EP 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-11571400-B2 ACAT1 inhibitors for treating cancer ACAT2, ACAT1, CEPT1 SOAT1 149/4885ACAT1 2/4885KDM4E 272/4885
US-11911469-B2 Combination of ACAT1 inhibitor and checkpoint antibody for treating cancer CD274, PDCD1, PDCD4 SOAT1 1835/4885ACAT1 7/4885KDM4E 386/4885
US-20230372374-A1 VETERINARY PHARMACEUTICAL FORMULATIONS SLC5A2, SLC5A1, SLC2A8 SOAT1 1392/4885ACAT1 3476/4885KDM4E 1451/4885

“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.