SCHEMBL18665488

SCHEMBL18665488

CCCCCCCCCCCCc1csc(-c2cc3c(cc(-c4scc(CCCCCCCCCCCC)c4CCCCCCCCCCCC)c4nsnc43)c3nsnc23)c1CCCCCCCCCCCC

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 1/20 0.34
▸ TYR P14679 2/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ ALOX5 P09917 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL18665469 0.81 TYR (0.33) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL18665468 0.77 MEN1 (0.30) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL18665676 0.77 GPR35 (0.32) GPR35
SCHEMBL25450860 0.75 TYR (0.31) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL12170124 0.74 PTGS2 (0.34) ADORA2ATP53CYP3A4
SCHEMBL18665531 0.74 PTGS2 (0.34) ADORA2ATP53CYP3A4
SCHEMBL18665493 0.74 PTGS2 (0.34) ADORA2ATP53CYP3A4
SCHEMBL18666095 0.74 PTGS2 (0.34) ADORA2ATP53CYP3A4
SCHEMBL18665507 0.74 PTGS2 (0.34) ADORA2ATP53CYP3A4
SCHEMBL15458184 0.74 PTGS2 (0.34) ADORA2ATP53CYP3A4

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
WO-2017047808-A1 COPOLYMER, PHOTOELECTRIC CONVERSION ELEMENT, SOLAR BATTERY, AND SOLAR BATTERY MODULE 三菱化学株式会社 2017-03-23 — — WO disclosed
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