SCHEMBL5473239

SCHEMBL5473239

CC(=O)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.55
KDM1A O60341 1/20 0.48
MAOB P27338 1/20 0.48
CTSK P43235 2/20 0.48
GAA P10253 2/20 0.46
EPHX1 P07099 1/20 0.45
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
DRD2 P14416 4/20 0.42
EPHX2 P34913 2/20 0.42
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
DRD3 P35462 1/20 0.41
CYP2C9 P11712 1/20 0.40
HSD11B1 P28845 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL573238 1.00 BTK (0.55) BTKKDM1AMAOBCTSKGAA
SCHEMBL573239 1.00 BTK (0.55) BTKKDM1AMAOBCTSKGAA
SCHEMBL14270420 0.91 BTK (0.62) BTKKDM1AMAOBCTSKGAA
SCHEMBL22334237 0.91 BTK (0.62) BTKKDM1AMAOBCTSKGAA
SCHEMBL13337688 0.91 BTK (0.62) BTKKDM1AMAOBCTSKGAA
SCHEMBL2988884 0.91 BTK (0.62) BTKKDM1AMAOBCTSKGAA
SCHEMBL14261648 0.91 BTK (0.62) BTKKDM1AMAOBCTSKGAA
SCHEMBL14270414 0.91 BTK (0.62) BTKKDM1AMAOBCTSKGAA
SCHEMBL14261646 0.91 BTK (0.62) BTKKDM1AMAOBCTSKGAA
SCHEMBL10343938 0.89 BTK (0.61) BTKKDM1AMAOBCTSKGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583825-B2 Benzo[h]quinazolin-4-amine and thieno[3,2-h]quinazolin-4-amine derivatives for the treatment of cancer Redona Therapeutics, Inc. (US) 2026-03-24 US disclosed
US-20250195518-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2025-06-19 US disclosed
EP-4488271-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Japan Tobacco Inc. (JP) 2025-01-08 EP disclosed
CN-118765278-A Indazole compounds and pharmaceutical uses thereof 日本烟草产业株式会社 2024-10-11 CN disclosed
WO-2024020084-A1 HETEROARYL COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK4 BRISTOL-MYERS SQUIBB COMPANY (US) 2024-01-25 WO disclosed
US-20230365509-A1 BENZO[H]QUINAZOLIN-4-AMINE AND THIENO[3,2-H]QUINAZOLIN-4-AMINE DERIVATIVES FOR THE TREATMENT OF CANCER Redona Therapeutics, Inc. 2023-11-16 US disclosed
US-20230365509-A1 BENZO[H]QUINAZOLIN-4-AMINE AND THIENO[3,2-H]QUINAZOLIN-4-AMINE DERIVATIVES FOR THE TREATMENT OF CANCER Redona Therapeutics, Inc. 2023-11-16 US disclosed
US-RE49686-E1 Nitrogen-containing heterocyclic compound and use of same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-10 US disclosed
US-RE49686-E1 Nitrogen-containing heterocyclic compound and use of same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-10 US disclosed
US-11779578-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
WO-2023016447-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-02-16 WO disclosed
WO-2022074143-A1 BENZO[H]QUINAZOLIN-4-AMINE AND THIENO[3,2-H]QUINAZOLIN-4-AMINE DERIVATIVES FOR THE TREATMENT OF CANCER Basilea Pharmaceutica International AG (CH) 2022-04-14 WO disclosed
US-RE48334-E1 Nitrogen-containing heterocyclic compound and use of same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-12-01 US disclosed
US-20120245137-A1 ARYL SULPHONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS ZALICUS PHARMACEUTICALS LTD. (CA) 2012-09-27 US disclosed
US-20110178060-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE OF SAME TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-07-21 US disclosed
US-20090186874-A1 Carboxamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-07-23 US disclosed
US-20090186874-A1 Carboxamide derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-07-23 US disclosed
US-20070185088-A1 M3 muscarinic acetylchoine receptor antagonists GLAXO GROUP LIMITED (GB) 2007-08-09 US disclosed
EP-1119563-B1 TETRAHYDROBENZAZEPINE DERIVATIVES USEFUL AS MODULATORS OF DOPAMINE D3 RECEPTORS (ANTIPSYCHOTIC AGENTS) SMITHKLINE BEECHAM PLC (GB) 2006-02-01 EP disclosed
US-6605607-B1 Antihypertensives; hyperprolactinaemia related conditions; certain central nervous system disorders SMITHKLINE BEECHAM P.L.C. (GB) 2003-08-12 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 (8 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-20110178060-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE OF SAME NTSR2, BDKRB1, AVPR1B BTK 1928/4885KDM1A 3365/4885MAOB 273/4885
US-20230365509-A1 BENZO[H]QUINAZOLIN-4-AMINE AND THIENO[3,2-H]QUINAZOLIN-4-AMINE DERIVATIVES FOR THE TREATMENT OF CANCER H1-10, H1-3, H1-0 BTK 337/4885KDM1A 247/4885MAOB 20/4885
US-20250195518-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF HPGDS, PTGIS, HPGD BTK 2879/4885KDM1A 2584/4885MAOB 997/4885
US-20120245137-A1 ARYL SULPHONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS CACNA1I, CACNA1G, CACNA1A BTK 2591/4885KDM1A 3502/4885MAOB 484/4885
US-20090186874-A1 Carboxamide derivative and use thereof NTSR2, NTSR1, CNR2 BTK 2296/4885KDM1A 1841/4885MAOB 613/4885
US-20070185088-A1 M3 muscarinic acetylchoine receptor antagonists CHRM3, CHRM2, CHRM5 BTK 4857/4885KDM1A 4066/4885MAOB 619/4885
US-12583825-B2 Benzo[h]quinazolin-4-amine and thieno[3,2-h]quinazolin-4-amine derivatives for the treatment of cancer H1-3, RB1, H1-2 BTK 54/4885KDM1A 180/4885MAOB 357/4885
US-11779578-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 BTK 27/4885KDM1A 160/4885MAOB 2743/4885

“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.