SCHEMBL85799

SCHEMBL85799

CCCCCCCCCCCCc1cc(-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)sc1-c1ccc(-c2ccc(-c3sc(-c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3CCCCCC)s2)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 3/20 0.40
▸ ALOX15 P16050 4/20 0.39
▸ MAPT P10636 1/20 0.38
▸ LIPG Q9Y5X9 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ DHFR P00374 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ BID P55957 3/20 0.36
▸ MCL1 Q07820 3/20 0.36
▸ BCL2L1 Q07817 2/20 0.36
▸ BAK1 Q16611 2/20 0.36
▸ HSD11B1 P28845 1/20 0.36
▸ KAT8 Q9H7Z6 1/20 0.36

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
SCHEMBL85697 0.99 LTB4R (0.39) LTB4RALOX15MAPTLIPGKCNH2
SCHEMBL85705 0.97 LTB4R (0.41) LTB4RALOX15MAPTLIPGKCNH2
SCHEMBL85806 0.97 LTB4R (0.41) LTB4RALOX15MAPTLIPGKCNH2
SCHEMBL85459 0.96 LTB4R (0.41) LTB4RALOX15MAPTLIPGKCNH2
SCHEMBL85694 0.96 LTB4R (0.41) LTB4RALOX15MAPTLIPGKCNH2
SCHEMBL13839139 0.95 LTB4R (0.40) LTB4RALOX15MAPTLIPGKCNH2
SCHEMBL12354335 0.95 LTB4R (0.40) LTB4RALOX15MAPTLIPGKCNH2
SCHEMBL85689 0.95 LTB4R (0.40) LTB4RALOX15MAPTLIPGKCNH2
SCHEMBL85814 0.94 ALOX15 (0.37) LTB4RALOX15MAPTKDM4ENPC1
SCHEMBL13410134 0.94 LTB4R (0.43) LTB4RALOX15MAPTKDM4EALDH1A1

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-8129497-B2 Organic thin film transistor KONICA MINOLTA HOLDINGS, INC. (JP) 2012-03-06 — — US disclosed
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