SCHEMBL4184972

SCHEMBL4184972

CCc1ccccc1SC(=S)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.43
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ MAPT P10636 4/20 0.37
▸ HTT P42858 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL22092402 0.81 PKM (0.43) ACHESMN1; SMN2NPC1MAPTLMNA
SCHEMBL13534776 0.80 RAB9A (0.51) ACHESMN1; SMN2NPC1RAB9AMAPT
SCHEMBL28856472 0.78 ACHE (0.45) ACHESMN1; SMN2MAPTHTTALDH1A1
SCHEMBL1080945 0.78 ACHE (0.45) ACHESMN1; SMN2MAPTHTTLMNA
SCHEMBL28856465 0.78 ACHE (0.45) ACHEHDAC3HDAC4HDAC1HDAC7
SCHEMBL9124737 0.76 ACHE (0.44) ACHESMN1; SMN2MAPTHTTLMNA
SCHEMBL27265426 0.76 ACHE (0.44) ACHESMN1; SMN2MAPTHTTLMNA
SCHEMBL2130135 0.76 ACHE (0.44) ACHESMN1; SMN2MAPTHTTLMNA
SCHEMBL29004554 0.76 ACHE (0.44) ACHEMAPTHTTCYP2D6CYP2C9
SCHEMBL14021117 0.75 CES2 (0.44) ACHESMN1; SMN2MAPTHTTLMNA

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-20090233817-A1 Methods for Testing the Effect of Polymer Additives on Wax Deposition from Crude Oils and Reducing Wax Deposition from Crude Oil During Pipeline Transmission KRIEGEL ROBERT M 2009-09-17 — — US disclosed
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