SCHEMBL55502

SCHEMBL55502

CC(CO)(CO)NC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA7 P43166 2/20 0.40
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
CA12 O43570 2/20 0.38
CA14 Q9ULX7 2/20 0.38
APLNR P35414 1/20 0.38
AAK1 Q2M2I8 6/20 0.38
DGAT1 O75907 1/20 0.37
CTSK P43235 2/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL19997953 0.88 CA1 (0.41) TDP1CA1CA2CA7MEN1
SCHEMBL19940938 0.88 CA1 (0.41) TDP1CA1CA2CA7MEN1
SCHEMBL13700790 0.86 TDP1 (0.56) TDP1CA1CA2CA7MEN1
SCHEMBL18138208 0.86 TDP1 (0.40) TDP1CA1CA2CA7MEN1
SCHEMBL30326251 0.85 AAK1 (0.50) AAK1
SCHEMBL18124759 0.85 TDP1 (0.42) TDP1CA1CA7MEN1GAA
SCHEMBL19935593 0.85 TDP1 (0.42) TDP1CA1CA7MEN1GAA
SCHEMBL15241159 0.85 AAK1 (0.50) AAK1
SCHEMBL18125237 0.85 TDP1 (0.42) TDP1CA1CA7MEN1GAA
SCHEMBL19520047 0.83 TDP1 (0.41) TDP1CA1CA7MEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118515643-A Preparation method of 3-methyl thiobuxine-3-amine hydrochloride 南京合巨药业有限公司 2024-08-20 CN claimed
US-20260008787-A1 FUSED RING KRAS INHIBITORS FOR TREATING DISEASE BLOSSOMHILL THERAPEUTICS INC (US) 2026-01-08 US disclosed
US-20250154169-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING REMIX THERAPEUTICS INC. 2025-05-15 US disclosed
EP-4551577-A1 FUSED RING KRAS INHIBITORS FOR TREATING DISEASE Blossomhill Therapeutics, Inc. (US) 2025-05-14 EP disclosed
US-20240343720-A1 AAK1 INHIBITOR AND USE THEREOF XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) 2024-10-17 US disclosed
CN-118515643-A Preparation method of 3-methyl thiobuxine-3-amine hydrochloride 南京合巨药业有限公司 2024-08-20 CN disclosed
CN-118515643-A Preparation method of 3-methyl thiobuxine-3-amine hydrochloride 南京合巨药业有限公司 2024-08-20 CN disclosed
EP-4395892-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING Remix Therapeutics Inc. (US) 2024-07-10 EP disclosed
CN-118302426-A Compounds and methods for modulating splicing 雷密克斯医疗公司 2024-07-05 CN disclosed
US-20240216291-A1 Nucleic Acid Containing Nanoparticles BIO TRIP B V (NL) 2024-07-04 US disclosed
EP-1300405-B1 AMINO ALCOHOL DERIVATIVES SANKYO CO (JP) 2007-04-18 EP disclosed
US-7199150-B2 Amino alcohol compounds SANKYO COMPANY, LIMITED (JP) 2007-04-03 US disclosed
EP-1733724-A1 AMINO ALCOHOL COMPOUND Sankyo Company, Limited (JP) 2006-12-20 EP disclosed
US-6964976-B2 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2005-11-15 US disclosed
US-20050043386-A1 Amino alcohol derivatives or phosphonic acid derivatives and pharmaceutical compositions containing these SANKYO COMPANY, LIMITED (JP) 2005-02-24 US disclosed
EP-1471054-A1 AMINO ALCOHOL DERIVATIVE OR PHOSPHONIC ACID DERIVATIVE AND MEDICINAL COMPOSITION CONTAINING THESE Sankyo Company, Limited (JP) 2004-10-27 EP disclosed
US-20040132784-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-08 US disclosed
US-6723745-B2 PREVENTION OR TREATMENT OF AUTOIMMUNE DISEASE IN WARM BLOODED ANIMAL SANKYO COMPANY, LIMITED (JP) 2004-04-20 US disclosed
US-20030236297-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2003-12-25 US disclosed
EP-1300405-A1 AMINO ALCOHOL DERIVATIVES Sankyo Company, Limited (JP) 2003-04-09 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 (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-20030236297-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A TDP1 3661/4885CA1 1663/4885CA2 3439/4885
US-20050043386-A1 Amino alcohol derivatives or phosphonic acid derivatives and pharmaceutical compositions containing these PHOSPHO1, CD4, FCGRT TDP1 3885/4885CA1 1102/4885CA2 2361/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A TDP1 3661/4885CA1 1663/4885CA2 3439/4885
US-20240216291-A1 Nucleic Acid Containing Nanoparticles APOB, APOL1, TLR3 TDP1 831/4885CA1 3979/4885CA2 4266/4885
US-20240343720-A1 AAK1 INHIBITOR AND USE THEREOF AAK1, ADCK1, ADCK5 TDP1 2824/4885CA1 1640/4885CA2 1540/4885
US-20250154169-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING RBM17, SNRPA, SNRPA1 TDP1 406/4885CA1 4082/4885CA2 4843/4885
US-20260008787-A1 FUSED RING KRAS INHIBITORS FOR TREATING DISEASE KRAS, NRAS, HRAS TDP1 4547/4885CA1 3143/4885CA2 3768/4885

“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.