SCHEMBL15040912

SCHEMBL15040912

COCCN(C)c1ccc(C=O)s1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GRM1 Q13255 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
SCHEMBL32676101 0.85 ALDH1A1 (0.37) ALDH1A1ADRA1DADRA1AADRA1BMEN1
SCHEMBL1959113 0.81 ALDH1A1 (0.39) ALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL14327712 0.81 ALDH1A1 (0.34) ALDH1A1KDM4E
SCHEMBL15040939 0.78 ALDH1A1 (0.44) ALDH1A1KDM4EHPGD
SCHEMBL15034609 0.75 CRHR1 (0.31) ALDH1A1KDM4EHPGDTSHR
SCHEMBL3496100 0.73 HTR2C (0.40) ALDH1A1KDM4EHPGDTSHRGRM1
SCHEMBL3053124 0.73 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL21036842 0.72 DPP4 (0.41) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL32676100 0.70 MAPT (0.36) ALDH1A1
SCHEMBL7647247 0.69 ALDH1A1 (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130157191-A1 TONER FOR ELECTROPHOTOGRAPHY AND IMAGE-FORMING METHOD KONICA MINOLAT BUSINESS TECHNOLOGIES, INC. (JP) 2013-06-20 US disclosed