SCHEMBL6542930

SCHEMBL6542930

CC(C)(C)[Si](C)(C)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.52
CA2 P00918 1/20 0.52
KMT2A Q03164 1/20 0.47
HPGD P15428 1/20 0.47
PREP P48147 4/20 0.46
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CA12 O43570 2/20 0.44
CA9 Q16790 2/20 0.44
NR4A2 P43354 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
SRD5A2 P31213 2/20 0.43
PARP15 Q460N3 1/20 0.43
PARP10 Q53GL7 1/20 0.43
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL2500559 0.87 ELANE (0.52) CA1KMT2AHPGDPREPCA12
SCHEMBL936407 0.85 MAPT (0.53) CA1KMT2AHPGDPREPTSHR
SCHEMBL5280416 0.84 ELANE (0.57) PREPSRD5A2ALDH1A1
SCHEMBL7291293 0.84 PREP (0.45) CA1CA2HPGDPREPCA12
SCHEMBL12339125 0.84 PARP10 (0.53) CA1CA2KMT2APREPCA12
SCHEMBL9011038 0.83 KMT2A (0.50) CA1CA2KMT2AHPGDTP53
SCHEMBL15779472 0.82 MAPT (0.50) KMT2APREPHSD17B10PARP10ALDH1A1
SCHEMBL1604136 0.82 PREP (0.44) CA1CA2PREPHSD17B10CA12
SCHEMBL8906116 0.82 CA1 (0.56) CA1CA2KMT2APREPTSHR
SCHEMBL6763899 0.82 PREP (0.53) CA1CA2PREPCA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12133852-B2 ACSS2 inhibitors and methods of use thereof EPIVARIO, INC. (US) 2024-11-05 US disclosed
CN-112159373-B Compound and application thereof in preparation of targeted PTL and/or NPC1L1 inhibition drugs 青岛大学 2023-10-20 CN disclosed
US-20220306677-A1 COMPOSITIONS AND METHODS FOR MAKING HYBRID POLYPEPTIDES YALE UNIVERSITY 2022-09-29 US disclosed
US-20220305010-A1 ACSS2 INHIBITORS AND METHODS OF USE THEREOF METABOMED LTD. (IL) 2022-09-29 US disclosed
CN-111808059-B Tumor diagnosis and treatment fluorescent probe targeting tumor Woberg effect 天津大学 2022-09-02 CN disclosed
CN-113149930-B Cell sugar transport channel inhibitor 天津大学 2022-09-02 CN disclosed
WO-2022063071-A1 COMPOUND AND USE THEREOF IN PREPARATION OF DRUG FOR TARGETED INHIBITION OF PTL AND/OR NPC1L1 青岛大学 2022-03-31 WO disclosed
CN-114008025-A ACSS2 inhibitors and methods of use thereof 美特波米德有限公司 2022-02-01 CN disclosed
US-20210002251-A1 Bruton's Tyrosine Kinase Inhibitors PFIZER INC. (US) 2021-01-07 US disclosed
CN-112159373-A Compound and application thereof in preparation of PTL and/or NPC1L1 targeted inhibition drugs 青岛大学附属医院 2021-01-01 CN disclosed
US-5830920-A PREVENTION GROWTH OF SMOOTH MUSCLE CELLS HOFFMANN-LA ROCHE INC. (US) 1998-11-03 US disclosed
US-5750706-A TREATMENT OF INFLAMMATORY SKIN DISORDERS AND ALOPECIA HOFFMANN-LA ROCHE INC. (US) 1998-05-12 US disclosed
US-5583222-A ANTIINFLAMMATORY AGENTS FOR TREATMENT OF SKIN DISORDERS HOFFMANN-LA ROCHE INC. (US) 1996-12-10 US disclosed
EP-0741128-A2 Sulphuric acid esters of sugar alcohols for the inhibition of the migration and proliferation of smooth muscle cells of the vascular walls F. HOFFMANN-LA ROCHE AG (CH) 1996-11-06 EP disclosed
EP-0654995-B1 4-OXA-1-AZABICYCLO (3,2,0) HEPTAN-7-ONE DERIVATIVES AS ANTITUMOR AGENTS TAIHO PHARMACEUTICAL CO LTD (JP) 1996-10-23 EP disclosed
US-5561126-A OXAPENAMS HAVING CHEMICAL STABILITY; ANTICARCINOGENIC AGENTS; LEUKEMIA TAIHO PHARMACEUTICAL CO., LTD. (JP) 1996-10-01 US disclosed
EP-0663393-A1 Novel 3-amino/hydroxy-4- 4-benzoylphenylcarboxylamino/oxy -azepanes and their homologies as protein kinase inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1995-07-19 EP disclosed
EP-0654995-A1 4-OXA-1-AZABICYCLO (3,2,0) HEPTAN-7-ONE DERIVATIVES AS ANTITUMOR AGENTS. TAIHO PHARMACEUTICAL CO LTD (JP) 1995-05-31 EP disclosed
WO-1994001109-A1 4-OXA-1-AZABICYCLO [3,2,0] HEPTAN-7-ONE DERIVATIVES AS ANTITUMOR AGENTS TAIHO PHARMACEUTICAL CO. LTD. (JP) 1994-01-20 WO disclosed
EP-0438873-A1 Inhibitor of ribonucleotide reductase of herpes viruses MERCK & CO. INC. (US) 1991-07-31 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 (4 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-20220306677-A1 COMPOSITIONS AND METHODS FOR MAKING HYBRID POLYPEPTIDES NSUN3, TARBP1, TRDMT1 CA1 2704/4885CA2 3555/4885KMT2A 1954/4885
US-20210002251-A1 Bruton's Tyrosine Kinase Inhibitors BTK, LCK, LYN CA1 4586/4885CA2 3764/4885KMT2A 1780/4885
US-20220305010-A1 ACSS2 INHIBITORS AND METHODS OF USE THEREOF ACSS2, GLS2, ADSS2 CA1 634/4885CA2 1483/4885KMT2A 1401/4885
US-12133852-B2 ACSS2 inhibitors and methods of use thereof ACSS2, GLS2, ADSS2 CA1 634/4885CA2 1483/4885KMT2A 1401/4885

“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.