SCHEMBL21151763

SCHEMBL21151763

CC#Cc1ccccc1N(C)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHKA P35790 6/20 0.36
CYP1A1 P04798 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP1B1 Q16678 1/20 0.35
EGFR P00533 2/20 0.35
SRC P12931 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
NR3C2 P08235 1/20 0.33
PTPN1 P18031 1/20 0.32
CES1 P23141 1/20 0.32
HDAC6 Q9UBN7 2/20 0.32
CHKB Q9Y259 1/20 0.31
GSK3B P49841 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
SCHEMBL14565683 0.79 MAPT (0.39) CYP1A1CYP1A2CYP1B1EGFRMEN1
SCHEMBL8568767 0.78 HDAC6 (0.45) CHKAMEN1KMT2AHTTPTGS1
SCHEMBL7155151 0.76 MEN1 (0.46) CHKAEGFRSRCMEN1KMT2A
SCHEMBL28620170 0.75 HSP90AA1 (0.54) MEN1KMT2AHTTHDAC6
SCHEMBL30129611 0.75 HSP90AA1 (0.54) MEN1KMT2AHTTHDAC6
SCHEMBL6364807 0.71 CYP1A2 (0.46) CYP1A1CYP1A2CYP1B1MEN1KMT2A
SCHEMBL10802759 0.70 CHKA (0.42) CHKAEGFRMEN1KMT2AHTT
SCHEMBL2198610 0.69 TSHR (0.41) CHKAEGFRSRCMEN1KMT2A
SCHEMBL10112125 0.69 MEN1 (0.39) CHKACYP1A2EGFRSRCMEN1
SCHEMBL20384981 0.69 TSHR (0.41) CHKAEGFRSRCMEN1KMT2A

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-2019136442-A1 CD16A BINDING AGENTS AND USES THEREOF KLEO PHARMACEUTICALS, INC. (US) 2019-07-11 WO disclosed