SCHEMBL4024770

SCHEMBL4024770

CCCC1CC(=O)N(Cn2cnc(C(=O)OC)c2C(=O)OC)C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
BRD4 O60885 1/20 0.32
STAT5B P51692 1/20 0.31

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
SCHEMBL662150 0.81 BRD4 (0.32) BRD4
SCHEMBL2954642 0.79 CYP11B1 (0.40) BRD4
SCHEMBL2955159 0.73 POLB (0.32) BRD4
SCHEMBL661400 0.73 TLR8 (0.41) BRD4
SCHEMBL4025360 0.73 HCAR2 (0.32) BRD4
SCHEMBL662267 0.72 CYP2C9 (0.34) ALDH1A1BRD4
SCHEMBL660548 0.72 ALDH1A1 (0.41) ALDH1A1BRD4
SCHEMBL20591073 0.71 ALDH1A1 (0.40) ALDH1A1STAT5B
SCHEMBL663057 0.71 BRD4 (0.35) ALDH1A1BRD4
SCHEMBL12724434 0.71 ALDH1A1 (0.41) ALDH1A1BRD4STAT5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2050736-A1 Imidazole derivatives, processes for preparing them and their uses UCB Pharma, S.A. (BE) 2009-04-22 EP disclosed
EP-1706376-B1 IMIDAZOLE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES UCB PHARMA SA (BE) 2009-03-04 EP disclosed