SCHEMBL15545547

SCHEMBL15545547

COc1ccc(C(=O)c2cc(CC(=O)NC(=N)NC(=O)O)c(-c3ccc(Cl)c(Cl)c3)s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
RXFP1 Q9HBX9 1/20 0.49
MAPT P10636 5/20 0.41
EIF4E P06730 1/20 0.38
HPGD P15428 4/20 0.36
LMNA P02545 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTSD P07339 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
RPA1 P27694 3/20 0.35
OPRD1 P41143 1/20 0.35

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
SCHEMBL15545760 0.91 MEN1 (0.55) KMT2AMEN1RXFP1MAPTHPGD
SCHEMBL18035703 0.90 KMT2A (0.46) KMT2AMEN1RXFP1MAPTEIF4E
SCHEMBL15547477 0.89 KMT2A (0.48) KMT2AMEN1RXFP1MAPTEIF4E
SCHEMBL16893498 0.89 KMT2A (0.44) KMT2AMEN1RXFP1MAPTEIF4E
Hydrochloric Acid SCHEMBL16893531 0.88 KMT2A (0.48) KMT2AMEN1RXFP1MAPTEIF4E
SCHEMBL18035674 0.85 KMT2A (0.47) KMT2AMEN1RXFP1MAPTEIF4E
SCHEMBL15546009 0.85 KMT2A (0.66) KMT2AMEN1RXFP1MAPTEIF4E
SCHEMBL15546529 0.83 MEN1 (0.49) KMT2AMEN1RXFP1MAPTEIF4E
SCHEMBL16893474 0.81 MEN1 (0.52) KMT2AMEN1RXFP1MAPTHPGD
SCHEMBL28819583 0.81 KMT2A (0.50) KMT2AMEN1RXFP1MAPTEIF4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2875010-B1 THIOPHENE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES METABRAIN RES (FR) 2016-08-31 EP claimed
EP-2875010-A1 THIOPHENE DERIVATIVES USED IN THE TREATMENT OF DIABETES Metabrain Research (FR) 2015-05-27 EP claimed
WO-2014013181-A1 THIOPHENE DERIVATIVES USED IN THE TREATMENT OF DIABETES METABRAIN RESEARCH (FR) 2014-01-23 WO claimed