SCHEMBL17414636

SCHEMBL17414636

CSc1cc(F)c(F)cc1-c1ccc(OCc2nc(C(=O)Cl)cs2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
POLB P06746 1/20 0.47
HSP90AA1 P07900 1/20 0.43
GYS1 P13807 2/20 0.42
MAPK1 P28482 1/20 0.42
PPARD Q03181 4/20 0.39
PPARA Q07869 2/20 0.38
MMP13 P45452 3/20 0.36
MMP1 P03956 2/20 0.36
MMP2 P08253 2/20 0.36
MMP9 P14780 2/20 0.36
GALR3 O60755 1/20 0.35
BCHE P06276 1/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 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
SCHEMBL17414642 0.91 POLB (0.48) MAPTNPC1RAB9AL3MBTL1POLB
SCHEMBL17414635 0.85 POLB (0.51) MAPTNPC1RAB9AL3MBTL1POLB
SCHEMBL17414665 0.82 POLB (0.41) MAPTNPC1RAB9AL3MBTL1POLB
SCHEMBL17414634 0.80 GYS1 (0.47) L3MBTL1POLBGYS1
SCHEMBL17414633 0.80 GYS1 (0.45) L3MBTL1POLBGYS1
SCHEMBL17414648 0.79 POLB (0.38) MAPTNPC1RAB9AL3MBTL1POLB
SCHEMBL17414656 0.79 GYS1 (0.47) MAPTNPC1RAB9AL3MBTL1POLB
SCHEMBL17414643 0.78 GYS1 (0.46) MAPTNPC1RAB9AL3MBTL1POLB
SCHEMBL17414663 0.77 GYS1 (0.40) MAPTNPC1RAB9AL3MBTL1POLB
SCHEMBL17414644 0.77 GYS1 (0.47) MAPTNPC1RAB9AL3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016002853-A1 MEDICINAL COMPOSITION FOR TREATING DIABETES 味の素株式会社 2016-01-07 WO disclosed