SCHEMBL22099652

SCHEMBL22099652

CCCNC(=S)NCc1ccc(CCC)cc1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
ALOX12 P18054 3/20 0.53
GAA P10253 3/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
PLA2G1B P04054 1/20 0.52
ATG4B Q9Y4P1 1/20 0.52
ALDH1A1 P00352 2/20 0.51
PKM P14618 1/20 0.51
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
ALPL P05186 1/20 0.49
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL13360297 0.87 POLB (0.57) KMT2AMEN1ALOX12GAAPOLB
SCHEMBL18159147 0.84 ALOX12 (0.74) KMT2AMEN1ALOX12GAAPOLB
SCHEMBL8388698 0.81 CA9 (0.55) ALOX12GAAPOLBMAPTALDH1A1
SCHEMBL25184062 0.75 ALOX12 (0.61) KMT2AMEN1ALOX12GAAPOLB
SCHEMBL12980282 0.73 TRPV1 (0.60) ALOX12MAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL1276262 0.73 ALDH1A1 (0.56) KMT2AMEN1ALOX12GAAMAPT
SCHEMBL18771294 0.72 HRH4 (0.53) KMT2AMEN1GAAMAPTSMN1; SMN2
SCHEMBL11239091 0.72 ALOX12 (0.86) KMT2AMEN1ALOX12GAAPOLB
SCHEMBL19234514 0.72 KMT2A (0.61) KMT2APOLBMAPTALDH1A1SMN1; SMN2
SCHEMBL26262850 0.72 LPL (0.44) KMT2AGAAPOLBALDH1A1

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-2019092618-A9 GLP-1 RECEPTOR LIGAND MOIETY CONJUGATED OLIGONUCLEOTIDES AND USES THEREOF IONIS PHARMACEUTICALS, INC (US) 2020-06-18 WO disclosed