SCHEMBL10854255

SCHEMBL10854255

CCOC(=O)N1CCN(CCCN)CC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 14/20 0.53
HRH1 P35367 14/20 0.53
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
POLB P06746 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HRH3 Q9Y5N1 2/20 0.49

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
SCHEMBL11182660 0.95 HRH2 (0.52) HRH2HRH1ALDH1A1KDM4EPOLB
SCHEMBL4050766 0.89 ALDH1A1 (0.53) HRH2HRH1ALDH1A1KDM4EPOLB
SCHEMBL29991910 0.87 HRH2 (0.56) HRH2HRH1POLBSMN1; SMN2HRH3
SCHEMBL14670199 0.86 HRH2 (0.56) HRH2HRH1ALDH1A1POLBHTT
SCHEMBL27629332 0.84 HRH2 (0.59) HRH2HRH1ALDH1A1POLBHTT
SCHEMBL11392680 0.84 HRH2 (0.55) HRH2HRH1ALDH1A1POLBHTT
SCHEMBL11747160 0.83 HRH2 (0.60) HRH2HRH1ALDH1A1POLBHTT
SCHEMBL3270714 0.83 ALDH1A1 (0.59) HRH2HRH1ALDH1A1POLBHTT
SCHEMBL5537946 0.83 HRH2 (0.53) HRH2HRH1ALDH1A1POLBHTT
SCHEMBL9047895 0.83 HRH2 (0.60) HRH2HRH1ALDH1A1POLBHTT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0095029-B1 5-THIO-TETRAZOL COMPOUNDS AND THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-11-05 EP disclosed
US-4563524-A INTERMEDIATES FOR CEPHALOSPORIN ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-07 US disclosed
EP-0029998-B1 CEPHEM COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-03-06 EP disclosed
US-4443443-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-04-17 US disclosed
EP-0095029-A1 5-Thio-tetrazol compounds and their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-30 EP disclosed
EP-0029998-A2 Cephem compounds, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-06-10 EP disclosed