SCHEMBL14722326

SCHEMBL14722326

NC(=O)c1ccccc1CC1CSC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 2/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
METAP2 P50579 1/20 0.38
BRD4 O60885 1/20 0.38
GAA P10253 1/20 0.38
FABP4 P15090 1/20 0.37
BCAT2 O15382 1/20 0.37
GRIK1 P39086 2/20 0.36
NPC1 O15118 1/20 0.36
MAPK8 P45983 1/20 0.35
ATM Q13315 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP6 Q9GZR1 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
SCHEMBL2303340 0.84 KDM4E (0.44) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL22123312 0.84 TP53 (0.40) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL9996739 0.81 TP53 (0.47) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL29818185 0.81 TP53 (0.43) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL4707109 0.80 TP53 (0.49) KMT2AMEN1BRD4FABP4NPC1
SCHEMBL3330911 0.78 AURKA (0.49) GRIK1
SCHEMBL19283285 0.78 KDM4E (0.38) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL15389531 0.78 KDM4E (0.42) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL21590173 0.75 CNR1 (0.44) KDM4EALDH1A1TSHRHSD17B10MAPT
SCHEMBL30002493 0.75 PARP2 (0.46) MAPTBRD4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2748155-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2014-07-02 EP disclosed
WO-2013026931-A1 ISOXAZOLINE DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-02-28 WO disclosed