SCHEMBL90804

SCHEMBL90804

C1CC[C@@H]2NCCC[C@H]2C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MBTD1 Q05BQ5 3/20 0.44
L3MBTL3 Q96JM7 2/20 0.44
EPAS1 Q99814 1/20 0.42
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
NOS2 P35228 2/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL13612540 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL242797 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL26722446 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL12699779 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL4189941 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL8825950 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL13447 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL166482 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL14621027 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1
SCHEMBL937629 1.00 MBTD1 (0.44) MBTD1L3MBTL3EPAS1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080262233-A1 SYNTHESIS OF PREFFERED ISOMER FRACTIONS OF N, N-DIETHYLDECAHYDROQUINOLINIUM CATION CHEVRON U.S.A. INC. 2008-10-23 US claimed
WO-2008048858-A2 SYNTHESIS OF PREFERRED ISOMER FRACTIONS OF N,N-DIETHYLDECAHYDROQUINOLINIUM CATION CHEVRON U.S.A. INC. (US) 2008-04-24 WO claimed
EP-0250179-A2 BCD tricyclic ergoline part-structure analogues ELI LILLY AND COMPANY (US) 1987-12-23 EP claimed
US-12612371-B2 Sigma-1 receptor ligands and therapeutic uses thereof UNIVERSITE DE STRASBOURG (FR) 2026-04-28 US disclosed
US-12351570-B2 Disubstituted alkyne derivatives MERCK PATENT GMBH (DE) 2025-07-08 US disclosed
WO-2025132943-A1 DECAHYDROQUINOLINES AS DNA POLYMERASE THETA INHIBITORS BREAKPOINT THERAPEUTICS GMBH (DE) 2025-06-26 WO disclosed
EP-4554569-A1 AGENT CONTAINING MALONIC ACID OR ITS DERIVATIVES FOR RESTORING METAL HOMEOSTASIS Oxford Antibiotic Group GmbH (AT) 2025-05-21 EP disclosed
CN-119866217-A Agent for restoring metal steady state containing malonic acid or derivative thereof 牛津抗生素(制药)集团股份有限公司 2025-04-22 CN disclosed
EP-4076456-B1 SIGMA-1 RECEPTOR LIGANDS AND THERAPEUTIC USES THEREOF UNIV STRASBOURG (FR) 2024-05-01 EP disclosed
WO-2024013400-A1 AGENT CONTAINING MALONIC ACID OR ITS DERIVATIVES FOR RESTORING METAL HOMEOSTASIS OXFORD ANTIBIOTIC GROUP GMBH (AT) 2024-01-18 WO disclosed
EP-4306107-A1 METAL HOMEOSTASIS RESTORATION AGENT Oxford Antibiotic Group GmbH (AT) 2024-01-17 EP disclosed
EP-0006540-B1 N-DICHLOROACETYL-1,2,3,4-TETRAHYDROQUINALDINE, PROCESS FOR OBTAINING IT, ITS USE FOR PREVENTING CROPS FROM BEING DAMAGED BY HERBICIDES AND SELECTIVE HERBICIDAL COMPOSITIONS BASED ON N-DICHLOROACETYL-1,2,3,4-TETRAHYDROQUINALDINE AND HERBICIDAL ACETANILIDES OR THIOLCARBAMATES BAYER AG (DE) 1981-10-07 EP disclosed
EP-0023305-A1 Use of N,N'-bis(halogen-acyl)-diaza-cycloalkanes for the protection of cultivated plants against damage by herbicides BAYER AG (DE) 1981-02-04 EP disclosed
EP-0023308-A1 N-acyl-piperidone cetals, process for their preparation and their use as antidotes in the protection of crop plants against damage by herbicides BAYER AG (DE) 1981-02-04 EP disclosed
EP-0023287-A1 Antidote for the protection of cultivated plants against damage by herbicides BAYER AG (DE) 1981-02-04 EP disclosed
EP-0006542-A2 The use of N-dichloroacetyl-1,2,3,4-tetrahydroisoquinolin as antidote for the protection of cultivated plants against damage caused by herbicidally active acetanilides; combinations thus obtained and process for their preparation BAYER AG (DE) 1980-01-09 EP disclosed
US-3992387-A PLANT GROWTH REGULATORS, HERBICIDES AND FUNGICIDES CIBA-GEIGY CORPORATION (US) 1976-11-16 US disclosed
US-3969367-A PLANT GROWTH REGULATOR, HERBICIDE, FUNGICIDE CIBA-GEIGY CORPORATION (US) 1976-07-13 US disclosed
US-3955957-A Phosphoryl-acylamines for inhibiting plant growth CIBA-GEIGY CORPORATION (US) 1976-05-11 US disclosed
US-3941579-A Regulating the growth of plants and controlling weeds with carbonyl-substituted azabicycloalkanes CIBA-GEIGY CORPORATION (US) 1976-03-02 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 (3 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-12612371-B2 Sigma-1 receptor ligands and therapeutic uses thereof SIGMAR1, OPRL1, OPRM1 MBTD1 4335/4885L3MBTL3 2381/4885EPAS1 2313/4885
US-12351570-B2 Disubstituted alkyne derivatives BRCA1, MYC, PCNA MBTD1 2598/4885L3MBTL3 846/4885EPAS1 489/4885
US-20080262233-A1 SYNTHESIS OF PREFFERED ISOMER FRACTIONS OF N, N-DIETHYLDECAHYDROQUINOLINIUM CATION DDAH1, HCN2, HCN1 MBTD1 3920/4885L3MBTL3 4192/4885EPAS1 2241/4885

“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.