SCHEMBL15030952

SCHEMBL15030952

Cc1c(C)c(=O)n(C)n(C)c1=O

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
GSK3A P49840 2/20 0.30
GSK3B P49841 2/20 0.30
ADRA2C P18825 1/20 0.30
MGLL Q99685 1/20 0.30

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
SCHEMBL14791106 0.83 ALDH1A1 (0.32) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL10216420 0.78 KDM4E (0.35) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL9513144 0.78 BCHE (0.32)
SCHEMBL10049703 0.69 KDM4E (0.32) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL24332723 0.67
SCHEMBL12761194 0.65
SCHEMBL14047854 0.65 KDM4E (0.40) KDM4EMEN1MAPTKMT2A
SCHEMBL9657109 0.65 BCHE (0.50)
SCHEMBL5533633 0.65 ADRA2C (0.33) KDM4EGSK3AGSK3BADRA2C
SCHEMBL23201571 0.64 BRD4 (0.41) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9265767-B2 1,2-disubstituted heterocyclic compounds FORUM PHARMACEUTICALS INC. (US) 2016-02-23 US disclosed
US-8933074-B2 1,2-disubstituted heterocyclic compounds FORUM PHARMACEUTICALS INC. (US) 2015-01-13 US disclosed
US-8466148-B2 1,2-disubstituted heterocyclic compounds ENVIVO PHARMACEUTICALS, INC. (US) 2013-06-18 US disclosed