SCHEMBL8567225

SCHEMBL8567225

CON=C(C(=O)O)c1nsc(NC(=O)OCc2ccccc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TSHR P16473 3/20 0.45
ALDH1A1 P00352 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
HSD17B10 Q99714 1/20 0.45
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.41
GLS O94925 1/20 0.41
ATM Q13315 1/20 0.39
MGLL Q99685 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL8567222 1.00 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
SCHEMBL8566765 0.90 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
SCHEMBL8566767 0.90 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
SCHEMBL8572505 0.84 ALDH1A1 (0.41) SMN1; SMN2MEN1KMT2AALDH1A1CYP1A2
SCHEMBL8572512 0.84 ALDH1A1 (0.41) SMN1; SMN2MEN1KMT2AALDH1A1CYP1A2
SCHEMBL8571932 0.82 MAPT (0.40) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
SCHEMBL8571928 0.82 MAPT (0.40) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
SCHEMBL8569577 0.82 SMN1; SMN2 (0.52) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
SCHEMBL8566734 0.81 ADORA3 (0.53) SMN1; SMN2CYP2C9RAB9ANPC1NPSR1
SCHEMBL8566729 0.81 ADORA3 (0.53) SMN1; SMN2CYP2C9RAB9ANPC1NPSR1

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
US-5705650-A Process for preparing 1,2,4-thiadiazole derivatives KATAYAMA SEIYAKUSYO CO., LTD. (JP) 1998-01-06 US disclosed
US-5585494-A Process for preparing 1,2,4-thiadiazole derivatives KATAYAMA SEIYAKUSYO CO. LTD. (JP) 1996-12-17 US disclosed
EP-0536900-A2 Process for preparing 1,2,4-Thiadiazole Derivatives KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1993-04-14 EP disclosed