SCHEMBL3229774

SCHEMBL3229774

CCCCOP(=O)(OCCCC)Oc1cccc(Br)c1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.46
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43

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
SCHEMBL18540627 0.90 AKR1C2 (0.48) AKR1C2AKR1C1
SCHEMBL7768583 0.89 CYP3A4 (0.53) CYP3A4
SCHEMBL17925155 0.86 CETP (0.42) AKR1C2AKR1C1
SCHEMBL25284051 0.84 CYP3A4 (0.47) CYP3A4
SCHEMBL3230130 0.83 CYP3A4 (0.53) CYP3A4
SCHEMBL3234331 0.82 CYP3A4 (0.46) CYP3A4
SCHEMBL27042296 0.82 KMT2A (0.50) CYP3A4
SCHEMBL19904729 0.82 TSHR (0.55) CYP3A4
SCHEMBL124571 0.81 CYP3A4 (0.55) CYP3A4
SCHEMBL31169485 0.81 CYP3A4 (0.47) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024020507-A2 ORGANOPHOSPHOROUS COMPOUNDS AND USES THEREOF JAL THERAPEUTICS, LLC (US) 2024-01-25 WO claimed
US-20260015372-A1 Organophosphorous Compounds and Uses Thereof JAL THERAPEUTICS LLC (US) 2026-01-15 US disclosed
WO-2024020507-A2 ORGANOPHOSPHOROUS COMPOUNDS AND USES THEREOF JAL THERAPEUTICS, LLC (US) 2024-01-25 WO disclosed
WO-2024020507-A2 ORGANOPHOSPHOROUS COMPOUNDS AND USES THEREOF JAL THERAPEUTICS, LLC (US) 2024-01-25 WO disclosed
US-20180104263-A1 BUTYRYLCHOLINESTERASE INHIBITORS JAL THERAPEUTICS, LLC 2018-04-19 US disclosed
US-20180104263-A1 BUTYRYLCHOLINESTERASE INHIBITORS JAL THERAPEUTICS, LLC 2018-04-19 US disclosed
US-20180104263-A1 BUTYRYLCHOLINESTERASE INHIBITORS JAL THERAPEUTICS, LLC 2018-04-19 US disclosed
EP-2097428-B1 BUTYRYLCHOLINESTERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES MGP BIOTECHNOLOGIES INC (US) 2018-02-28 EP disclosed
EP-2097428-B1 BUTYRYLCHOLINESTERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES MGP BIOTECHNOLOGIES INC (US) 2018-02-28 EP disclosed
US-9757399-B2 Butyrylcholinesterase inhibitors JAL THERAPEUTICS, INC. (US) 2017-09-12 US disclosed
US-20160206635-A1 Butyrylcholinesterase Inhibitors JAL THERAPEUTICS, LLC 2016-07-21 US disclosed
US-20140073608-A1 Butyrylcholinesterase Inhibitors MGP BIOTECHNOLOGIES, LLC (US) 2014-03-13 US disclosed
US-20140073608-A1 Butyrylcholinesterase Inhibitors MGP BIOTECHNOLOGIES, LLC (US) 2014-03-13 US disclosed
US-20140073608-A1 Butyrylcholinesterase Inhibitors MGP BIOTECHNOLOGIES, LLC (US) 2014-03-13 US disclosed
US-20100069337-A1 BUTYRYLCHOLINESTERASE INHIBITORS JAL THERAPEUTICS, LLC 2010-03-18 US disclosed
US-20100069337-A1 BUTYRYLCHOLINESTERASE INHIBITORS JAL THERAPEUTICS, LLC 2010-03-18 US disclosed
US-20100069337-A1 BUTYRYLCHOLINESTERASE INHIBITORS JAL THERAPEUTICS, LLC 2010-03-18 US disclosed
EP-2097428-A2 BUTYRYLCHOLINESTERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES Mgp Biotechnologies, Inc. (US) 2009-09-09 EP disclosed
WO-2008055249-A2 BUTYRYLCHOLINESTERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES MGP BIOTECHNOLOGIES, INC. (US) 2008-05-08 WO disclosed
WO-2008055249-A2 BUTYRYLCHOLINESTERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES MGP BIOTECHNOLOGIES, INC. (US) 2008-05-08 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 (5 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-20180104263-A1 BUTYRYLCHOLINESTERASE INHIBITORS BCHE, ACHE, PSEN1 CYP3A4 1055/4885AKR1C2 3348/4885AKR1C1 3415/4885
US-20160206635-A1 Butyrylcholinesterase Inhibitors BCHE, ACHE, PSEN1 CYP3A4 1055/4885AKR1C2 3348/4885AKR1C1 3415/4885
US-20140073608-A1 Butyrylcholinesterase Inhibitors BCHE, ACHE, PSEN1 CYP3A4 1055/4885AKR1C2 3348/4885AKR1C1 3415/4885
US-20100069337-A1 BUTYRYLCHOLINESTERASE INHIBITORS BCHE, ACHE, PSEN1 CYP3A4 1055/4885AKR1C2 3348/4885AKR1C1 3415/4885
US-20260015372-A1 Organophosphorous Compounds and Uses Thereof ACHE, BCHE, MUSK CYP3A4 1005/4885AKR1C2 4690/4885AKR1C1 4714/4885

“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.