SCHEMBL8635747

SCHEMBL8635747

CCCn1c(=NC(=O)NOC)sc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.49
CNR2 P34972 4/20 0.49
ALDH1A1 P00352 6/20 0.47
NPSR1 Q6W5P4 4/20 0.47
TSHR P16473 2/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 5/20 0.45
TP53 P04637 1/20 0.44
RECQL P46063 1/20 0.44
MAPT P10636 6/20 0.44
SMN1; SMN2 Q16637 6/20 0.44
RAB9A P51151 6/20 0.44
NPC1 O15118 5/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
MEN1 O00255 3/20 0.43
MITF O75030 1/20 0.43
KDM4E B2RXH2 4/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL8633551 0.93 CNR1 (0.55) CNR1CNR2ALDH1A1NPSR1TSHR
SCHEMBL8637902 0.91 CNR1 (0.59) CNR1CNR2ALDH1A1NPSR1TSHR
SCHEMBL8635422 0.90 NPSR1 (0.58) CNR1CNR2ALDH1A1NPSR1TSHR
SCHEMBL8635413 0.89 HPGD (0.49) CNR1CNR2ALDH1A1NPSR1TSHR
SCHEMBL8636648 0.86 ALDH1A1 (0.46) CNR1CNR2ALDH1A1NPSR1TSHR
SCHEMBL8634997 0.84 KDM4E (0.49) ALDH1A1NPSR1TSHRMAPK1KMT2A
SCHEMBL8635929 0.84 LMNA (0.44) CNR1CNR2ALDH1A1NPSR1TSHR
SCHEMBL8637865 0.84 NPSR1 (0.64) ALDH1A1NPSR1TSHRMAPK1KMT2A
SCHEMBL8638139 0.83 KDM4E (0.50) ALDH1A1NPSR1TSHRMAPK1KMT2A
SCHEMBL8637025 0.83 NPSR1 (0.47) ALDH1A1NPSR1TSHRMAPK1KMT2A

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