SCHEMBL8636804

SCHEMBL8636804

C=CCn1c(=NC(=O)NOC(C)C)sc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.46
MAPT P10636 6/20 0.46
HPGD P15428 3/20 0.46
ALDH1A1 P00352 9/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 1/20 0.44
NPSR1 Q6W5P4 4/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
GAA P10253 3/20 0.43
POLB P06746 2/20 0.43
PSMD14 O00487 1/20 0.43
MC4R P32245 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
HTT P42858 2/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
TRPM5 Q9NZQ8 1/20 0.41

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
SCHEMBL8638139 0.88 KDM4E (0.50) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL8637958 0.86 ALDH1A1 (0.46) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL8635416 0.84 KDM4E (0.45) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL8638211 0.83 ALDH1A1 (0.47) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL8635470 0.82 KDM4E (0.44) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL8635369 0.82 KDM4E (0.47) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL9159146 0.82 KDM4E (0.53) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL9159142 0.82 KDM4E (0.53) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL8637007 0.78 ALDH1A1 (0.43) KDM4EMAPTHPGDALDH1A1NPC1
SCHEMBL8635121 0.78 ALDH1A1 (0.43) KDM4EMAPTHPGDALDH1A1NPC1

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-0568096-B1 Benzothiazole derivative and agricultural and horticultural fingicide composition containing the same HODOGAYA CHEMICAL CO LTD (JP) 1998-07-29 EP claimed
EP-0568096-A1 Benzothiazole derivative and agricultural and horticultural fingicide composition containing the same HODOGAYA CHEMICAL CO., LTD. (JP) 1993-11-03 EP claimed