SCHEMBL5575415

SCHEMBL5575415

CCCCCCc1cc(-c2sc(-c3ccc4cc5ccccc5cc4c3)cc2CCCCCC)sc1-c1ccc2cc3ccccc3cc2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 2/20 0.36
▸ LIPG Q9Y5X9 1/20 0.35
▸ MAOA P21397 2/20 0.34
▸ LTB4R Q15722 2/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ MAOB P27338 1/20 0.32
▸ DHFR P00374 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ TYR P14679 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32

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
SCHEMBL3780304 0.89 ESR1 (0.37) TLR8LIPGMAOALTB4RESR1
SCHEMBL3774900 0.85 TLR8 (0.36) TLR8LIPGMAOAESR1ESR2
SCHEMBL13446389 0.81 LTB4R (0.42) LIPGLTB4RMAPTDHFRALOX15
SCHEMBL13142470 0.81 TLR8 (0.34) TLR8LIPGMAOAMAPTMAOB
SCHEMBL4356751 0.80 TLR8 (0.38) TLR8LIPGMAOAMAPTMAOB
SCHEMBL12921560 0.79 GCGR (0.39) TLR8LIPGLTB4RMAPTMEN1
SCHEMBL21243813 0.78 LTB4R (0.44) LIPGLTB4RMAPTDHFRALOX15
SCHEMBL13410246 0.78 ESR1 (0.32) ESR1ESR2MAPTMEN1TP53
SCHEMBL13197199 0.78 AGER (0.34) —
SCHEMBL13410145 0.77 ESR1 (0.31) ESR1ESR2MAPTMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276395-B2 Acene-thiophene semiconductors 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-10-02 — — US disclosed
US-7276395-B2 Acene-thiophene semiconductors 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-10-02 — — US disclosed
EP-1654248-A1 ACENE-THIOPHENE SEMICONDUCTORS 3M Innovative Properties Company (US) 2006-05-10 — — EP disclosed
US-20060033086-A1 Depositing a gate electrode material on the substrate;depositing a gate dielectric on the gate electrode material;depositing an organic semiconductor layer comprising acene-thiophene compounds, providing a source electrode and a drain electrode contiguous to the organic semiconductor layer GERLACH CHRISTOPHER P 2006-02-16 — — US disclosed
US-6998068-B2 Acene-thiophene semiconductors 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-02-14 — — US disclosed
WO-2005019198-A1 ACENE-THIOPHENE SEMICONDUCTORS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-03-03 — — WO disclosed
US-20050035333-A1 Acene-thiophene semiconductors 3M INNOVATIVE PROPERTIES COMPANY 2005-02-17 — — US disclosed
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