SCHEMBL16950516

SCHEMBL16950516

C=[C]c1cccc(SC)c1OCC

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ NPC1 O15118 3/20 0.34
▸ RAB9A P51151 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL16960042 0.81 KDM4E (0.36) LMNAMAPTKMT2AMEN1KDM4E
SCHEMBL16956475 0.77 SCN4A (0.38) LMNAMAPTKDM4EALDH1A1GAA
SCHEMBL16958481 0.77 ALDH1A1 (0.41) LMNANPSR1MAPTKMT2AMEN1
SCHEMBL16953864 0.77 LMNA (0.37) LMNANPSR1NPC1RAB9AMAPT
SCHEMBL16957240 0.76 THRB (0.33) NPSR1MAPTKMT2AHTTMEN1
SCHEMBL16950501 0.76 L3MBTL1 (0.40) NPSR1NPC1RAB9AMAPTKMT2A
SCHEMBL16951614 0.76 NQO1 (0.31) —
SCHEMBL16959771 0.76 GAA (0.39) LMNANPC1RAB9AMAPTKMT2A
SCHEMBL16954482 0.76 GAA (0.35) LMNANPC1RAB9AMAPTHTT
SCHEMBL16958355 0.76 L3MBTL1 (0.44) LMNANPC1RAB9AMAPTKMT2A

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
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 — — EP disclosed
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