SCHEMBL21241801

SCHEMBL21241801

CN(C)Sc1cccc(C(=O)NCC(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HPGD P15428 2/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 3/20 0.46
POLB P06746 1/20 0.46
PTPRC P08575 2/20 0.45
CTSL P07711 1/20 0.45
PTPN13 Q12923 1/20 0.45
MAPT P10636 1/20 0.43
HIF1A Q16665 1/20 0.43
SLC22A6 Q4U2R8 1/20 0.43
SLC22A8 Q8TCC7 1/20 0.43
MAPK1 P28482 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
GAA P10253 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PLA2G10 O15496 1/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL21241844 0.85 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1KMT2APOLBNPC1
SCHEMBL20979707 0.83 ALDH1A1 (0.54) KDM4ESMN1; SMN2HPGDALDH1A1KMT2A
SCHEMBL21242060 0.80 F2R (0.50) KDM4ESMN1; SMN2HPGDALDH1A1KMT2A
SCHEMBL1840451 0.79 KDM4E (0.60) KDM4ESMN1; SMN2HPGDALDH1A1KMT2A
SCHEMBL20826224 0.78 HSD17B10 (0.63) KDM4EHPGDALDH1A1KMT2APOLB
SCHEMBL21241848 0.77 ADORA3 (0.44) KMT2ANPC1RAB9AMEN1
SCHEMBL1285808 0.75 NPC1 (0.63) KDM4ESMN1; SMN2HPGDALDH1A1KMT2A
SCHEMBL609165 0.75 ATM (0.57) KDM4ESMN1; SMN2HPGDALDH1A1CTSL
SCHEMBL29417854 0.75 NPC1 (0.63) KDM4ESMN1; SMN2HPGDALDH1A1KMT2A
SCHEMBL29780425 0.75 KDM4E (0.56) KDM4ESMN1; SMN2HPGDALDH1A1KMT2A

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-2019152437-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2019-08-08 WO disclosed