SCHEMBL16957446

SCHEMBL16957446

CCOc1c(CO)cccc1SC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APOBEC3G Q9HC16 1/20 0.41
▸ LMNA P02545 5/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ NPC1 O15118 4/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ HTT P42858 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.36
▸ GAA P10253 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ CYP4F2 P78329 2/20 0.35
▸ CYP4A11 Q02928 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL16957328 0.83 CYP4F2 (0.42) APOBEC3GNPSR1NPC1RAB9AKMT2A
SCHEMBL16952045 0.82 APOBEC3G (0.44) APOBEC3GLMNAKMT2AMAPTALDH1A1
SCHEMBL12482259 0.78 GABRA1 (0.45) LMNANPSR1NPC1RAB9AKMT2A
SCHEMBL7669246 0.77 ALDH1A1 (0.46) LMNANPSR1NPC1RAB9AKMT2A
SCHEMBL16953866 0.77 GRM5 (0.41) LMNANPSR1NPC1RAB9AKMT2A
SCHEMBL9653476 0.77 CYP4F2 (0.41) LMNANPC1RAB9AKMT2AMAPT
SCHEMBL9195589 0.77 ALDH1A1 (0.42) LMNANPSR1NPC1RAB9AKMT2A
SCHEMBL16957573 0.77 CYP4F2 (0.41) LMNANPC1RAB9AKMT2AMAPT
SCHEMBL16953864 0.75 LMNA (0.37) LMNANPSR1NPC1RAB9AKMT2A
SCHEMBL21859573 0.75 L3MBTL1 (0.40) LMNANPSR1NPC1RAB9AKMT2A

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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