SCHEMBL24727

SCHEMBL24727

CC[N]C1CCCCC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11259580 1.00 EPHX1 (0.39)
SCHEMBL465769 0.97
SCHEMBL919637 0.91
SCHEMBL424456 0.84
SCHEMBL26068 0.78 CYP1A2 (0.37)
SCHEMBL8393739 0.78 CYP1A2 (0.37)
SCHEMBL8790273 0.76 TSHR (0.38)
SCHEMBL10607610 0.75 EPHX1 (0.43)
SCHEMBL8565556 0.74
SCHEMBL193152 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024145585-A1 COMPOUNDS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-07-04 WO claimed
CN-101193891-A 2-thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA (JP) 2008-06-04 CN claimed
EP-1303496-B9 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2008-03-19 EP claimed
EP-1303496-B1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2007-09-12 EP claimed
US-6908920-B2 Pyrimidine derivatives ASTRAZENECA AB (SE) 2005-06-21 US claimed
JP-2004502763-A 2004-01-29 JP claimed
US-20030216406-A1 Pyrimidine derivatives ASTRAZENECA AB (SE) 2003-11-20 US claimed
EP-1303496-A1 PYRIMIDINE DERIVATIVES AstraZeneca AB (SE) 2003-04-23 EP claimed
WO-2002004429-A1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2002-01-17 WO claimed
WO-2001041763-A1 TREATMENT OF ADDICTION DISORDERS UNIVERSITY OF CINCINNATI (US) 2001-06-14 WO claimed
US-5455266-A Including an expectorant e.g bromhexine, ambroxol, dembrexine, and microbiocide in fish food; synergistic BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1995-10-03 US claimed
EP-0586738-A1 Enhanced chemotherapeutic compositions against microbial infections in fish containing a benzylamine derivative and an antimicrobial substance BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1994-03-16 EP claimed
EP-0587135-A1 Enhanced chemotherapeutic compositions against microbial infections in fish contaning a benzylamine derivative and an antimicrobial substance BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1994-03-16 EP claimed
EP-0088943-B1 COMPOSITION FOR THE RESORPTION OF INJECTED ANTIBACTERIAL SUBSTANCES AND MIXTURES CONTAINING A BENZYL AMINE DERIVATIVE BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1986-08-13 EP claimed
EP-0061746-B1 PHOSPHORAMIDITE COMPOUNDS AND THEIR USE IN PRODUCING OLIGONUCLEOTIDES UNIVERSITY PATENTS, INC. (US) 1985-03-20 EP claimed
US-4415732-A STORAGE-STABLE NUCLEOSIDES; POLYNUCLEOTIDE SYNTHESIS UNIVERSITY PATENTS, INC. (US) 1983-11-15 US claimed
US-4410708-A Chromogenic fluoran derivatives and the preparation and use thereof SHIN NISSO KAKO CO., LTD. (JP) 1983-10-18 US claimed
EP-0088943-A2 Composition for the resorption of injected antibacterial substances and mixtures containing a benzyl amine derivative BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1983-09-21 EP claimed
US-4341551-A HERBICIDES, FUNGICIDES, PLANT GROWTH REGULATORS SCHERING AG (DE) 1982-07-27 US claimed
US-4122089-A Aminothiofluoran compounds, process for the production thereof, and recording elements containing the same SANKIO CHEMICAL CO., LTD. (JP) 1978-10-24 US claimed