SCHEMBL11240981

SCHEMBL11240981

O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(OCc2cccs2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.46
▸ NPC1 O15118 6/20 0.46
▸ MAPT P10636 4/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ GAA P10253 2/20 0.45
▸ POLB P06746 2/20 0.43
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ THRB P10828 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ JAK2 O60674 1/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ TYK2 P29597 1/20 0.40

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
SCHEMBL11229738 0.83 DHODH (0.48) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL9834629 0.81 NPC1 (0.59) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL11272435 0.81 JAK2 (0.53) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11239092 0.81 MEN1 (0.58) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL11392829 0.79 MEN1 (0.59) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11244391 0.79 PPARA (0.49) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL11241566 0.79 MAPT (0.51) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11244542 0.79 RAB9A (0.43) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11236412 0.79 TDP1 (0.57) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11381816 0.79 NPC1 (0.50) RAB9ANPC1MEN1KMT2ASMN1; SMN2

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
US-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 — — US disclosed
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