SCHEMBL28016296

SCHEMBL28016296

Oc1ccccc1Sc1cccc(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.54
SLC6A4 P31645 1/20 0.54
SLC6A3 Q01959 1/20 0.54
RHEB Q15382 1/20 0.51
HPGD P15428 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
PLA2G1B P04054 1/20 0.47
HSP90AA1 P07900 1/20 0.47
CYP2D6 P10635 1/20 0.47
ALOX15 P16050 1/20 0.47
HTT P42858 1/20 0.47
HIF1A Q16665 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
DHFR P00374 1/20 0.47

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
SCHEMBL7938044 0.81 SMN1; SMN2 (0.47) SLC6A2SLC6A4SLC6A3HPGDALDH1A1
SCHEMBL11817929 0.81 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3RHEBHPGD
SCHEMBL901661 0.79 RHEB (0.45) SLC6A2SLC6A4SLC6A3RHEBHPGD
SCHEMBL28016923 0.79 SLC6A4 (0.50) SLC6A4RHEBHPGDMEN1KMT2A
SCHEMBL23674200 0.78 RHEB (0.55) SLC6A2SLC6A4SLC6A3RHEBHPGD
SCHEMBL29681501 0.78 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3RHEBHPGD
SCHEMBL29923046 0.78 RHEB (0.55) SLC6A2SLC6A4SLC6A3RHEBHPGD
SCHEMBL4337657 0.78 SLC6A9 (0.43) HPGDMEN1KMT2AALDH1A1HTT
SCHEMBL25704500 0.78 SLC6A2 (0.58) SLC6A2SLC6A4SLC6A3RHEBHPGD
SCHEMBL1341559 0.78 ALDH1A1 (0.57) SLC6A2SLC6A4SLC6A3RHEBHPGD

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
CN-104797567-B Dihydropyrone compound and herbicide containing the same 住友化学株式会社 2017-06-20 CN disclosed
CN-104797567-A Dihydropyrone compound and herbicide containing the same SUMITOMO CHEMICAL CO 2015-07-22 CN disclosed