SCHEMBL15979503

SCHEMBL15979503

CCCCCCc1cc(C)sc1-c1sc(-c2sc(C)cc2CCCCCC)c2c1C(=O)N(C)C2=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.35
▸ NR1H3 Q13133 1/20 0.35
▸ GPR84 Q9NQS5 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ TP53 P04637 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ G6PD P11413 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HCAR2 Q8TDS4 2/20 0.33
▸ GPR35 Q9HC97 1/20 0.33
▸ ACHE P22303 1/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ELANE P08246 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
SCHEMBL8739987 0.82 ALOX5 (0.42) TP53CYP3A4ALOX15TSHRGPR35
SCHEMBL12264581 0.82 ALOX5 (0.42) TP53CYP3A4ALOX15TSHRGPR35
SCHEMBL16307285 0.82 LTB4R (0.32) NR1H2NR1H3LTB4R
SCHEMBL16307242 0.81 PTGS1 (0.32) PTGS1PTGS2MGLLFAAH
SCHEMBL15702347 0.80 NR1H2 (0.32) NR1H2NR1H3GPR84
SCHEMBL16307286 0.80 HSF1 (0.33) NR1H2NR1H3PKMTP53CYP3A4
SCHEMBL13096347 0.78 PTGS1 (0.33) NR1H2NR1H3TP53CYP3A4ALOX15
SCHEMBL13096352 0.78 PTGS1 (0.33) NR1H2NR1H3TP53CYP3A4ALOX15
SCHEMBL14716455 0.75 PTGS1 (0.38) NR1H2NR1H3GPR84TP53CYP3A4
SCHEMBL14716549 0.75 PTGS1 (0.38) NR1H2NR1H3GPR84TP53CYP3A4

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-20140243488-A1 METHOD FOR PRODUCING CONJUGATED POLYMER, CONJUGATED POLYMER, PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND SOLAR CELL MODULE MITSUBISHI CHEMICAL CORPORATION (JP) 2014-08-28 — — US disclosed
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