SCHEMBL4597385

SCHEMBL4597385

CC(Cc1ccc(Br)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
KMT2A Q03164 1/20 0.57
MME P08473 6/20 0.51
TBXAS1 P24557 2/20 0.51
ACACB O00763 1/20 0.47
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
PTGS1 P23219 3/20 0.47
PTGS2 P35354 3/20 0.47
LMNA P02545 2/20 0.47
CYP2C9 P11712 2/20 0.47
AKR1C3 P42330 2/20 0.47
CXCR1 P25024 2/20 0.47
CXCR2 P25025 2/20 0.47
ALB P02768 1/20 0.47
ESR1 P03372 1/20 0.47
ALOX5 P09917 1/20 0.47
RARB P10826 1/20 0.47

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
SCHEMBL12939732 1.00 MEN1 (0.57) MEN1NPC1RAB9AKMT2AMME
SCHEMBL21129085 1.00 MEN1 (0.57) MEN1NPC1RAB9AKMT2AMME
SCHEMBL11237591 0.89 TBXAS1 (0.59) MMETBXAS1PTGS1PTGS2LMNA
SCHEMBL22235331 0.84 KMT2A (0.53) MEN1NPC1RAB9AKMT2AMME
SCHEMBL19553694 0.83 PTGS1 (0.66) TBXAS1PTGS1PTGS2LMNACYP2C9
SCHEMBL13643239 0.82 EPHX1 (0.57) MEN1NPC1RAB9AKMT2AMME
SCHEMBL30563831 0.82 KMT2A (0.51) MEN1NPC1RAB9AKMT2AMME
SCHEMBL2720266 0.82 EPHX1 (0.57) MEN1NPC1RAB9AKMT2AMME
SCHEMBL13968367 0.82 MEN1 (0.51) MEN1NPC1RAB9AKMT2AMME
SCHEMBL11996333 0.82 TBXAS1 (0.53) MEN1KMT2ATBXAS1ACACBPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024002270-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KIDNEY DISEASES AND KIDNEY-RELATED DISEASES SHANGHAI YAO YUAN BIOTECHNOLOGY CO., LTD. (CN) 2024-01-04 WO disclosed
US-11730714-B2 Compounds for the treatment of neuromuscular disorders NMD PHARMA A/S (DK) 2023-08-22 US disclosed
US-11730714-B2 Compounds for the treatment of neuromuscular disorders NMD PHARMA A/S (DK) 2023-08-22 US disclosed
EP-4222151-A1 ALPHA PROTEIN KINASE 1 INHIBITORS AND METHODS OF USE Shanghai Yao Yuan Biotechnology Co., Ltd. (CN) 2023-08-09 EP disclosed
WO-2023143603-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING ATHEROSCLEROSIS AND RELATED DISEASES SHANGHAI YAO YUAN BIOTECHNOLOGY CO., LTD. (CN) 2023-08-03 WO disclosed
WO-2022222888-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KAWASAKI DISEASE SHANGHAI YAO YUAN BIOTECHNOLOGY CO., LTD. (CN) 2022-10-27 WO disclosed
US-10934244-B2 Compounds for use in treating neuromuscular disorders NMD PHARMA A/S (DK) 2021-03-02 US disclosed
EP-3730502-A1 SYNTHESIS AND APPLICATION OF OXASPIROCYCLODIPHOSPHINE LIGAND SHENZHEN CATALYS TECHNOLOGY CO., LTD. (CN) 2020-10-28 EP disclosed
WO-2019153203-A1 SYNTHESIS AND APPLICATION OF OXASPIROCYCLODIPHOSPHINE LIGAND 凯特立斯(深圳)科技有限公司 2019-08-15 WO disclosed
WO-2018149419-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS, INC. (US) 2018-08-23 WO disclosed
EP-0832082-B1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ASTRAZENECA AB (SE) 2001-11-21 EP disclosed
US-6271248-B1 USED IN TREATING HYPERTENSION, PULMONARY HYPERTENSION, RENAL/ GLOMERULAR/MESANGIAL CELL DISORDERS, ENDOTOXEMIA, ISCHEMIA, TUMOR GROWTH, ATHERSCLEROSIS, RESTENOSIS, SUBARACHNOID HEMORRHAGE, PROSTATIC HYPERTROPHY, CONGESTIVE HEART FAILURE BRISTOL-MYERS SQUIBB COMPANY 2001-08-07 US disclosed
US-6258817-B1 PRODRUGS, HYPOTENSIVE AGENTS AND CARDIOVASCULAR DISORDERS ZENECA LTD. (GB) 2001-07-10 US disclosed
US-6080774-A Substituted biphenylsulfonamide endothelin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2000-06-27 US disclosed
US-6060475-A Substituted pyrazin-2-yl-sulphonamide-(3-pyridyl) compounds and uses thereof ZENECA LIMITED (GB) 2000-05-09 US disclosed
US-5866568-A ENDOTHELIN RECEPTOR ANTAGONIST ACTIVITY ZENECA LIMITED (GB) 1999-02-02 US disclosed
CN-1192739-A N-heteroaryl-pyridinesulfonamide derivatives and their use as endothelin antagonists ZENECA LTD (GB) 1998-09-09 CN disclosed
EP-0832082-A1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1998-04-01 EP disclosed
EP-0768305-A1 N-Isoxazolyl-biphenylsulfonamide derivatives, their preparation and their use as endothelin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 1997-04-16 EP disclosed
WO-1996040681-A1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1996-12-19 WO 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 (2 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-11730714-B2 Compounds for the treatment of neuromuscular disorders RYR1, CACNB1, RYR2 MEN1 2371/4885NPC1 2323/4885RAB9A 2235/4885
US-10934244-B2 Compounds for use in treating neuromuscular disorders CPT1B, CLCN2, TNNC1 MEN1 1797/4885NPC1 600/4885RAB9A 1171/4885

“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.