SCHEMBL12924385

SCHEMBL12924385

Cc1ccc(-c2sc(-c3ccc(C)cc3)c3c2-c2ccc4c5c(ccc-3c25)-c2ccccc2-4)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ XBP1 P17861 1/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ PHOSPHO1 Q8TCT1 1/20 0.35
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ TP53 P04637 2/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33
▸ L3MBTL1 Q9Y468 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
SCHEMBL12924417 0.91 KDM4E (0.40) ALOX5SMN1; SMN2MAPK1NPSR1MAPT
SCHEMBL12924389 0.78 MAPT (0.38) ALOX5MAPK1MAPTKDM4ELMNA
SCHEMBL12924231 0.76 LIMK1 (0.38) ALOX5MAPK1NPSR1MAPTLMNA
SCHEMBL12262883 0.75 ALOX5 (0.51) ALOX5SMN1; SMN2MAPK1NPSR1MAPT
SCHEMBL20872065 0.74 KDM4E (0.52) ALOX5SMN1; SMN2MAPK1NPSR1MAPT
SCHEMBL12924394 0.73 ALOX5 (0.33) ALOX5SMN1; SMN2MAPK1MAPTKDM4E
SCHEMBL12924414 0.73 RAB9A (0.43) SMN1; SMN2MAPTKDM4ELMNANPC1
SCHEMBL12924420 0.73 PDPK1 (0.47) ALOX5MAPTKDM4ETP53PTGS2
SCHEMBL12924363 0.73 PTGS2 (0.34) SMN1; SMN2MAPK1NPSR1MAPTKDM4E
SCHEMBL12924335 0.72 MAPK1 (0.37) SMN1; SMN2MAPK1NPSR1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8294144-B2 Organic transistor YAMAMOTO CHEMICALS, INC. (JP) 2012-10-23 — — US disclosed
US-20110012098-A1 ORGANIC TRANSISTOR YAMAMOTO CHEMICALS, INC. (JP) 2011-01-20 — — US disclosed
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