SCHEMBL9593142

SCHEMBL9593142

O=C(OC(=O)c1nsc(-c2ccccc2)c1C(=O)O)c1nsc(-c2ccccc2)c1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 4/20 0.39
GAA P10253 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HSD17B10 Q99714 2/20 0.39
HPGD P15428 2/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 2/20 0.39
LMNA P02545 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
GRM6 O15303 5/20 0.36
GRM5 P41594 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HTT P42858 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL11156557 0.86 KDM4E (0.51) KDM4EALDH1A1GAASMN1; SMN2HSD17B10
SCHEMBL9199770 0.75 ALDH1A1 (0.42) KDM4EALDH1A1GAASMN1; SMN2HSD17B10
SCHEMBL20027633 0.75 HPGD (0.44) KDM4EALDH1A1GAASMN1; SMN2HSD17B10
SCHEMBL3355557 0.75 KDM4E (0.42) KDM4EALDH1A1GAASMN1; SMN2HSD17B10
SCHEMBL30852420 0.71 KDM4E (0.46) KDM4EALDH1A1GAAHSD17B10LMNA
SCHEMBL21369992 0.70 KDM4E (0.55) KDM4EALDH1A1GAASMN1; SMN2HSD17B10
SCHEMBL1807037 0.69 KDM4E (0.50) KDM4EALDH1A1GAASMN1; SMN2HSD17B10
SCHEMBL1809679 0.69 KDM4E (0.54) KDM4EALDH1A1GAASMN1; SMN2HSD17B10
SCHEMBL2346052 0.69 DHODH (0.46) KDM4EALDH1A1GAASMN1; SMN2HPGD
SCHEMBL31526313 0.68 ALDH1A1 (0.58) KDM4EALDH1A1GAASMN1; SMN2HSD17B10

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-5201932-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1993-04-13 US disclosed