SCHEMBL13208024

SCHEMBL13208024

CCCCCCCCCCc1cc(C)sc1-c1cc(CCCCCCCCCC)c(-c2ccc(-c3ccc(-c4ccc(-c5sc(-c6sc(-c7ccc(C)cc7)cc6CCCCCCCCCC)cc5CCCCCCCCCC)s4)s3)s2)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.31
▸ TYR P14679 2/20 0.31
▸ TP53 P04637 2/20 0.31
▸ THRB P10828 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GPX4 P36969 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ PAX8 Q06710 1/20 0.30
▸ GCGR P47871 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
SCHEMBL13208025 1.00 MAPT (0.31) MAPTTYRTP53THRBBLM
SCHEMBL13114508 0.99 MAPT (0.32) MAPTTYRTP53THRBBLM
SCHEMBL13208026 0.99 MAPT (0.32) MAPTTYRTP53THRBBLM
SCHEMBL85441 0.99 MAPT (0.32) MAPTTYRTP53THRBBLM
SCHEMBL13114509 0.99 MAPT (0.32) MAPTTYRTP53THRBBLM
SCHEMBL13208021 0.98 MAPT (0.31) MAPTTYRTP53THRBBLM
SCHEMBL16706032 0.93 MAPT (0.31) MAPTTYRTP53THRBBLM
SCHEMBL13208051 0.92 CNR2 (0.34) —
SCHEMBL13208058 0.91 CNR2 (0.34) —
SCHEMBL2737068 0.91 ALOX5 (0.36) MAPTTYRTP53MEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781564-B2 Polythiophenes and devices thereof XEROX CORPORATION (US) 2010-08-24 — — US disclosed
US-20070228363-A1 POLYTHIOPHENES AND DEVICES THEREOF ONG BENG S 2007-10-04 — — US disclosed
US-7256418-B2 Polythiophenes and devices thereof XEROX CORPORATION (US) 2007-08-14 — — US disclosed
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