SCHEMBL14716549

SCHEMBL14716549

CCCCCCCCc1cc(Br)sc1-c1sc(-c2sc(Br)cc2CCCCCCCC)c2c1C(=O)N(CCCCCCCC)C2=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.38
▸ PTGS2 P35354 3/20 0.38
▸ MGLL Q99685 3/20 0.38
▸ FAAH O00519 1/20 0.38
▸ CDC25A P30304 8/20 0.34
▸ CES1 P23141 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ G6PD P11413 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ CNR1 P21554 1/20 0.33
▸ NR1H2 P55055 1/20 0.33
▸ NR1H3 Q13133 1/20 0.33
▸ ALDH2 P05091 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
SCHEMBL14716455 1.00 PTGS1 (0.38) PTGS1PTGS2MGLLFAAHCDC25A
SCHEMBL14716615 0.92 PTGS1 (0.40) PTGS1PTGS2MGLLFAAHCDC25A
SCHEMBL15779196 0.85 NR1H2 (0.30) NR1H2NR1H3
SCHEMBL14716581 0.81 PTGS1 (0.37) PTGS1PTGS2MGLLFAAHCDC25A
SCHEMBL14716279 0.81 PTGS1 (0.37) PTGS1PTGS2MGLLFAAHCDC25A
SCHEMBL4584517 0.81 ALOX5 (0.41) PTGS2TP53CYP3A4ALOX15TSHR
SCHEMBL2363742 0.81 ALOX5 (0.41) PTGS2TP53CYP3A4ALOX15TSHR
SCHEMBL2308334 0.81 ALOX5 (0.41) PTGS2TP53CYP3A4ALOX15TSHR
SCHEMBL15702333 0.80 PTGS1 (0.30) PTGS1PTGS2MGLLFAAHCDC25A
SCHEMBL15301226 0.80 CDC25A (0.37) PTGS1PTGS2MGLLFAAHCDC25A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170044309-A1 PREPARATION OF HIGH MOLECULAR WEIGHT POLYMERS BY DIRECT ARYLATION AND HETEROARYLATION UNIVERSITE LAVAL (CA) 2017-02-16 — — US disclosed
US-9505876-B2 Preparation of high molecular weight polymers by direct arylation and heteroarylation UNIVERSITE LAVAL (CA) 2016-11-29 — — US disclosed
US-20140371409-A1 PREPARATION OF HIGH MOLECULAR WEIGHT POLYMERS BY DIRECT ARYLATION AND HETEROARYLATION UNIVERSITE LAVAL (CA) 2014-12-18 — — US disclosed
US-8816035-B2 Photoactive polymers UNIVERSITE LAVAL (CA) 2014-08-26 — — US disclosed
US-20130048075-A1 NOVEL PHOTOACTIVE POLYMERS UNIVERSITE LAVAL (CA) 2013-02-28 — — US disclosed
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