SCHEMBL11166808

SCHEMBL11166808

Cc1ccccc1NC(=O)C1Sc2ccccc2N(C)C1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.49
MAPT P10636 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 4/20 0.43
GSK3B P49841 2/20 0.42
BRD4 O60885 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
HPGD P15428 3/20 0.41
KDM4E B2RXH2 1/20 0.41
RECQL P46063 1/20 0.41
GAA P10253 2/20 0.41
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL11096194 0.83 MEN1 (0.48) BCHEMAPTMEN1KMT2AALDH1A1
SCHEMBL11086091 0.82 MAPT (0.55) MAPTKMT2AALDH1A1NPC1KDM4E
SCHEMBL11095086 0.79 KMT2A (0.47) MAPTMEN1KMT2AALDH1A1GSK3B
SCHEMBL11092372 0.78 CCKBR (0.47) MAPTALDH1A1GSK3BNPC1RAB9A
SCHEMBL11088774 0.77 TDP1 (0.47) MEN1KMT2AALDH1A1GSK3BNPC1
SCHEMBL11089059 0.77 MAOA (0.43) MAPTALDH1A1GSK3BNPC1RAB9A
SCHEMBL11093789 0.76 CCKBR (0.48) MAPTMEN1KMT2AGSK3BNPC1
SCHEMBL11088184 0.75 GSK3B (0.39) MAPTMEN1KMT2AALDH1A1GSK3B
SCHEMBL11094189 0.74 TSHR (0.50) MAPTMEN1KMT2ARAB9AKDM4E
SCHEMBL11089030 0.73 KDM4E (0.55) BCHEMEN1KMT2AGSK3BKDM4E

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-4397849-A AUTOIMMUNE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-08-09 US disclosed