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SCHEMBL17528652

SCHEMBL17528652

CCCCCCCCCCCCc1cc(-c2ccc(-c3ccc(-c4cc(CCCCCCCCCCCC)c(-c5sc(C)c6c5C(=O)N(CCCCCCCC)C6=O)s4)s3)s2)sc1C

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.32
▸ PTGS2 P35354 3/20 0.32
▸ MGLL Q99685 2/20 0.32
▸ FAAH O00519 1/20 0.32
▸ CES1 P23141 2/20 0.31
▸ CDC25A P30304 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ G6PD P11413 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ NR1H2 P55055 1/20 0.31
▸ NR1H3 Q13133 1/20 0.31

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
SCHEMBL16307263 1.00 PTGS1 (0.32) PTGS1PTGS2MGLLFAAHCES1
SCHEMBL16307265 1.00 PTGS1 (0.32) PTGS1PTGS2MGLLFAAHCES1
SCHEMBL18504933 0.92 — —
SCHEMBL18504930 0.92 — —
SCHEMBL16307287 0.88 — —
SCHEMBL15702347 0.87 NR1H2 (0.32) NR1H2NR1H3
SCHEMBL16307262 0.87 — —
SCHEMBL16307264 0.86 KDM4E (0.34) ALDH1A1HPGD
SCHEMBL16307268 0.85 — —
SCHEMBL16307266 0.85 — —

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-2016021660-A1 COPOLYMER, PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL AND SOLAR CELL MODULE 三菱化学株式会社 2016-02-11 — — WO disclosed