SCHEMBL7079573

SCHEMBL7079573

Clc1ccc(Cc2cccs2)cc1Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.66
DRD2 P14416 1/20 0.47
DRD1 P21728 1/20 0.47
DRD4 P21917 1/20 0.47
DRD5 P21918 1/20 0.47
DRD3 P35462 1/20 0.47
LMNA P02545 5/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SLC6A2 P23975 2/20 0.45
SLC6A4 P31645 2/20 0.45
SLC6A3 Q01959 2/20 0.45
IDO1 P14902 2/20 0.44
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
OPRK1 P41145 2/20 0.43
ALDH1A1 P00352 4/20 0.42
POLB P06746 2/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 2/20 0.42

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
Benzoic Acid SCHEMBL10930082 0.85 L3MBTL1 (0.51) L3MBTL1LMNANPC1RAB9APTGS1
SCHEMBL923302 0.79 MEN1 (0.53) L3MBTL1DRD4DRD5LMNANPC1
SCHEMBL27959690 0.78 NPC1 (0.56) LMNANPC1RAB9AIDO1POLB
SCHEMBL1565021 0.77 L3MBTL1 (0.56) L3MBTL1DRD2DRD1DRD4DRD5
SCHEMBL1565023 0.76 L3MBTL1 (0.76) L3MBTL1LMNANPC1RAB9APOLB
SCHEMBL1397435 0.76 L3MBTL1 (0.76) L3MBTL1DRD2DRD4DRD3LMNA
SCHEMBL11314534 0.76 L3MBTL1 (0.46) L3MBTL1DRD2DRD1DRD4DRD5
SCHEMBL3298586 0.75 IDO1 (0.64) LMNASLC6A2SLC6A4SLC6A3IDO1
SCHEMBL4084648 0.74 PTGS1 (0.57) L3MBTL1LMNAPTGS1PTGS2ALDH1A1
SCHEMBL6222184 0.74 CA1 (0.57) DRD2DRD1DRD4DRD5DRD3

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
CN-113621005-A alpha-D-galactoside inhibitors of galectins 格莱克特生物技术公司 2021-11-09 CN disclosed
CN-107406478-B alpha-D-galactoside inhibitors of galectins 格莱克特生物技术公司 2021-07-27 CN disclosed
WO-2003051123-A1 ISOTHIAZOLYLAMINOCARBONYL DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2003-06-26 WO disclosed