SCHEMBL8973467

SCHEMBL8973467

C=Cc1ccc(C)c(N2C(=O)C=CC2=O)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 12/20 0.53
▸ TLR9 Q9NR96 2/20 0.42
▸ SRD5A1 P18405 1/20 0.41
▸ HSP90AA1 P07900 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CCR6 P51684 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ PKM P14618 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ NLRP1 Q9C000 1/20 0.41
▸ TP53 P04637 1/20 0.38
▸ G6PD P11413 1/20 0.38
▸ FAAH O00519 3/20 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
SCHEMBL7607085 0.79 MGLL (0.59) MGLLTLR9HSP90AA1ALDH1A1CCR6
SCHEMBL94095 0.77 MGLL (0.57) MGLLTLR9HSP90AA1CCR6TDP1
SCHEMBL10885514 0.76 TLR9 (0.41) MGLLTLR9SRD5A1HSP90AA1ALDH1A1
SCHEMBL10883126 0.76 TLR9 (0.64) MGLLTLR9SRD5A1HSP90AA1ALDH1A1
SCHEMBL9152877 0.76 MGLL (0.55) MGLLTLR9HSP90AA1ALDH1A1CCR6
SCHEMBL9418756 0.75 MGLL (0.58) MGLLTLR9HSP90AA1ALDH1A1CCR6
SCHEMBL10883347 0.75 ALDH1A1 (0.40) MGLLTLR9SRD5A1HSP90AA1ALDH1A1
SCHEMBL10883578 0.74 TLR9 (0.38) MGLLTLR9SRD5A1ALDH1A1MAPT
SCHEMBL5078134 0.73 MGLL (0.56) MGLLTLR9HSP90AA1ALDH1A1CCR6
SCHEMBL1258213 0.72 MGLL (0.65) MGLLHSP90AA1ALDH1A1CCR6TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5565536-A SETTING COMPOSITION COMPRISING CATIONIC POLYMERIZATION INITIATOR AND POLYMERIZABLE COMPOUND CONTAINING UNSATURATED IMIDE GROUP AND ADDITIONAL ANIONICALLY OR CATIONICALLY POLYMERIZABLE GROUP HITACHI, LTD. (JP) 1996-10-15 — — US disclosed
US-5410069-A Having unsaturated imide group on one end and styrene group on other; controlled curing condition due to difference in reactivity of functional groups; heat resistance, excellent formability, mechanical and electrical properties HITACHI, LTD. (JP) 1995-04-25 — — US disclosed
EP-0546550-A1 Polymerizable compound, process for producing same and setting composition containing polymerizable compound HITACHI, LTD. (JP) 1993-06-16 — — EP disclosed
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