SCHEMBL5414432

SCHEMBL5414432

CC1SCC(=O)N1CCC1CCCCN1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.35
HRH3 Q9Y5N1 2/20 0.33
PRKACA P17612 1/20 0.32
PRKACG P22612 1/20 0.32
PRKACB P22694 1/20 0.32
CAMK2D Q13557 1/20 0.32
POLB P06746 1/20 0.32
FDPS P14324 2/20 0.31
HTR1A P08908 1/20 0.31
HTR1D P28221 1/20 0.31
HTR2A P28223 1/20 0.31
HRH1 P35367 1/20 0.31
ADRA1B P35368 1/20 0.31
KCNH2 Q12809 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 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
SCHEMBL5394447 0.84 KMT2A (0.33) KMT2AHRH3PRKACAPRKACGPRKACB
SCHEMBL5394423 0.83 KMT2A (0.33) KMT2AHRH3PRKACAPRKACGPRKACB
SCHEMBL5417237 0.77 KMT2A (0.44) KMT2APOLBCYP2C9CYP2C19
SCHEMBL5403949 0.73 KMT2A (0.40) KMT2APRKACAPRKACGPRKACBCAMK2D
SCHEMBL5398650 0.73 KMT2A (0.40) KMT2APRKACAPRKACGPRKACBCAMK2D
SCHEMBL5394438 0.72 KMT2A (0.39) KMT2APRKACAPRKACGPRKACBCAMK2D
SCHEMBL5403560 0.72 CYP1A2 (0.42) KMT2ACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL19793237 0.70 FDPS (0.38) KMT2AHRH3PRKACAPRKACGPRKACB
SCHEMBL17525713 0.70 HRH3 (0.41) KMT2AHRH3PRKACAPRKACGPRKACB
SCHEMBL5414440 0.68 SLC6A3 (0.35)

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
US-7169782-B2 Aryl substituted thiazolidinones and the use thereof EURO-CELTIQUE S.A. (LU) 2007-01-30 US claimed