Bencyclane

Bencyclane

SCHEMBL220903

CN(C)CCCOC1(Cc2ccccc2)CCCCCC1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

The experimentally established mechanism targets of Bencyclane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HRH1 known ✓ P35367 2/20 0.52
▸ CHRM2 known ✓ P08172 3/20 0.42
▸ CHRM3 known ✓ P20309 3/20 0.42
▸ CTSK P43235 4/20 0.47
▸ CTSL P07711 3/20 0.47
▸ CTSB P07858 3/20 0.47
▸ CHRM1 P11229 3/20 0.42
▸ CHRM4 P08173 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ PKM P14618 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ BCHE P06276 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ AQP3 Q92482 1/20 0.38
▸ AQP1 P29972 1/20 0.38

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
Bencyclane SCHEMBL1568812 1.00 HRH1 (0.52) HRH1CTSKCTSLCTSBCHRM2
Bencyclane SCHEMBL20505617 0.99 HRH1 (0.51) HRH1CTSKCTSLCTSBCHRM2
Bencyclane SCHEMBL64881 0.90 AQP3 (0.44) HRH1CTSKCTSLCTSBCHRM2
Bencyclane SCHEMBL11215911 0.83 HRH1 (0.38) HRH1CTSKCTSLCTSBALDH1A1
Pyritinol SCHEMBL10629435 0.80 HRH1 (0.40) HRH1CTSKCTSLCTSBALDH1A1
SCHEMBL11666639 0.78 AQP1 (0.43) HRH1CTSKCTSLCTSBCHRM2
SCHEMBL13681480 0.77 AQP3 (0.50) HRH1CHRM2CHRM1CHRM3CHRM4
SCHEMBL11444307 0.76 HRH3 (0.50) CHRM2CHRM1ALDH1A1KDM4EAQP3
Etafenone SCHEMBL4715940 0.75 ABCB1 (0.48) ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL14409639 0.75 AQP3 (0.48) HRH1CHRM2CHRM1CHRM3CHRM4

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 1053 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12605345-B2 Transdermal drug delivery system BioPhysics Pharma, Inc. (US) 2026-04-21 — — US claimed
EP-4725506-A2 THE PEPTIDOMIMETIC COMPOUND (R)-2-AMINO-N-((S)-L-(((S)-5-AMINO-L-(3-BENZYL-1,2,4-OXADIAZOL-5-YL)PENTYL)AMINO)-3-(4-HYDROXY-2,6-DIMETHYLPHENYL)-1-OXOPROPAN-2-YL)-5-GUANIDINOPENTANAMIDE FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS Stealth BioTherapeutics Inc. (US) 2026-04-15 — — EP claimed
US-20260076872-A1 POLYMER VIALS WITH SUBSTANTIALLY FLAT BOTTOMS AND INJECTION STRETCH BLOW MOLDING METHODS FOR MAKING THE SAME SIO2 MEDICAL PRODUCTS LLC (US) 2026-03-19 — — US claimed
EP-3986401-B1 THE PEPTIDOMIMETIC COMPOUND (R)-2-AMINO-N-((S)-L-(((S)-5-AMINO-L-(3-BENZYL-1,2,4-OXADIAZOL-5-YL)PENTYL)AMINO)-3-(4-HYDROXY-2,6-DIMETHYLPHENYL)-1-OXOPROPAN-2-YL)-5-GUANIDINOPENTANAMIDE FOR USE IN THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS STEALTH BIOTHERAPEUTICS INC (US) 2026-01-28 — — EP claimed
US-20250268841-A1 Trans-Epithelial Membrane Drug Delivery System Masiz, John J. (US) 2025-08-28 — — US claimed
US-20250242092-A1 SiOx BARRIER FOR PHARMACEUTICAL PACKAGE AND COATING PROCESS SIO2 MEDICAL PRODUCTS INC (US) 2025-07-31 — — US claimed
US-20250120907-A1 Transmucosal Drug Delivery System Masiz, John J. (US) 2025-04-17 — — US claimed
US-12257371-B2 SiOx barrier for pharmaceutical package and coating process SIO2 MEDICAL PRODUCTS, LLC (US) 2025-03-25 — — US claimed
US-12246098-B2 Trans-epithelial membrane drug delivery system BioPhysics Pharma, Inc. (US) 2025-03-11 — — US claimed
WO-2024249914-A1 COMPOSITIONS AND METHODS FOR DIAGNOSING AND TREATING DYSTONIA DUKE UNIVERSITY (US) 2024-12-05 — — WO claimed
WO-2004075832-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CHRONIC PAIN USING DHEA AND DERIVATIVES THEREOF LUCAS JOHN M (US) 2004-09-10 — — WO claimed
CN-1468111-A Pharmaceutical composition for the treatment of acute, chronic pain and/or neuropathic pain and migraine �Ʒ� 2004-01-14 — — CN claimed
US-20030133951-A1 Pharmaceutical composition for treatment of acute, chronic pain and/or neuropathic pain and migraines PFIZER INC. 2003-07-17 — — US claimed
US-20020068718-A1 Chondroprotective/restorative compositions and methods of use thereof PIERCE SCOTT W (US) 2002-06-06 — — US claimed
US-20010036943-A1 Pharmaceutical composition for treatment of acute, chronic pain and/or neuropathic pain and migraines PFIZER PRODUCTS INC. 2001-11-01 — — US claimed
US-5811547-A Method for inducing crystalline state transition in medicinal substance NIPPON SHINYAJU CO., LTD. (JP) 1998-09-22 — — US claimed
US-4555398-A THERMOSETTING OR THERMOPLASTIC RESIN MOLD CHISSO CORPORATION (JP) 1985-11-26 — — US claimed
EP-0018773-B1 A PHARMACEUTICAL COMPOSITION CONTAINING BENCYCLANE FUMARATE, A PROCESS FOR ITS PREPARATION AND AN INCLUSION COMPOUND CONTAINING BENCYCLANE FUMARATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-06-22 — — EP claimed
US-4352793-A ANTICONVULSANTS, VASODILATORS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-10-05 — — US claimed
EP-0018773-A1 A pharmaceutical composition containing bencyclane fumarate, a process for its preparation and an inclusion compound containing bencyclane fumarate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-11-12 — — EP claimed

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-20260076872-A1 POLYMER VIALS WITH SUBSTANTIALLY FLAT BOTTOMS AND INJECTION STRETCH BLOW MOLDING METHODS FOR MAKING THE SAME MEN1, MYO1G, IL2 HRH1 1733/4885CHRM2 2228/4885CHRM3 2031/4885
US-12605345-B2 Transdermal drug delivery system FABP2, VEGFA, CUTA HRH1 1675/4885CHRM2 557/4885CHRM3 876/4885

“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.

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