SCHEMBL14716540

SCHEMBL14716540

CCCCCCCCN1C(=O)c2c(-c3sccc3CC)sc(-c3sccc3CC)c2C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.41
▸ PTGS2 P35354 3/20 0.41
▸ MGLL Q99685 2/20 0.41
▸ FAAH O00519 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ G6PD P11413 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CDC25A P30304 9/20 0.39
▸ CNR2 P34972 3/20 0.39
▸ CES1 P23141 2/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ ALDH2 P05091 1/20 0.37
▸ ALDH3A1 P30838 1/20 0.37

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
SCHEMBL12970623 0.92 ALDH1A1 (0.40) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL14716597 0.92 ALDH1A1 (0.40) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL14716539 0.78 ALDH1A1 (0.43) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL2009284 0.78 ALDH1A1 (0.43) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL14716615 0.77 PTGS1 (0.40) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL20434474 0.76 CDC25A (0.47) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL20434455 0.76 CDC25A (0.47) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL20434462 0.76 CDC25A (0.47) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL15422601 0.74 MGLL (0.43) PTGS1PTGS2MGLLFAAHALDH1A1
SCHEMBL14560516 0.74 ALDH1A1 (0.45) PTGS1PTGS2MGLLFAAHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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