SCHEMBL7968328

SCHEMBL7968328

CN(C)C=C1CC=CC2=C1CC(=O)C2

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL4587406 0.62
SCHEMBL4594105 0.58
SCHEMBL29694511 0.57 MEN1 (0.38) KDM4EMEN1KMT2A
SCHEMBL6961530 0.56 KDM4E (0.31) KDM4EMEN1KMT2A
SCHEMBL13100853 0.56 MEN1 (0.44) KDM4EMEN1KMT2A
SCHEMBL9398448 0.56 KDM4E (0.30) KDM4EMEN1KMT2A
SCHEMBL15470504 0.54 MEN1 (0.35) KDM4EMEN1KMT2A
SCHEMBL12919957 0.54 SMARCA4 (0.36) KDM4EMEN1KMT2A
SCHEMBL8619088 0.54
SCHEMBL8615812 0.54

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001087845-A2 N-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE AS 5-HT ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-11-22 WO disclosed