SCHEMBL28156519

SCHEMBL28156519

Cn1cnc2cc(N=O)ccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ GRM5 P41594 1/20 0.47
▸ NAMPT P43490 1/20 0.46
▸ KMT2A Q03164 2/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ NPC1 O15118 9/20 0.43
▸ RAB9A P51151 9/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ GAA P10253 4/20 0.43
▸ TP53 P04637 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ KDM4E B2RXH2 3/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ GFER P55789 1/20 0.41
▸ SHMT2 P34897 1/20 0.40

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
SCHEMBL2094047 0.76 ALDH1A1 (0.54) ALDH1A1MAPTGRM5NAMPTKMT2A
SCHEMBL20986068 0.73 KMT2A (0.53) ALDH1A1MAPTGRM5NAMPTKMT2A
SCHEMBL434799 0.73 NPC1 (0.58) ALDH1A1MAPTGRM5KMT2AHDAC1
SCHEMBL212673 0.72 MAPT (0.61) ALDH1A1MAPTGRM5KMT2AHDAC1
SCHEMBL4814996 0.72 GRM5 (0.51) ALDH1A1MAPTGRM5KMT2AHDAC1
SCHEMBL16132873 0.72 GRM5 (0.51) ALDH1A1MAPTGRM5KMT2AHDAC1
SCHEMBL5343727 0.72 GRM5 (0.51) ALDH1A1MAPTGRM5KMT2AHDAC1
SCHEMBL1496402 0.72 FGFR1 (0.54) ALDH1A1MAPTGRM5NAMPTKMT2A
SCHEMBL6761540 0.72 GRM5 (0.51) ALDH1A1MAPTGRM5KMT2AHDAC1
SCHEMBL615432 0.72 GRM5 (0.51) ALDH1A1MAPTGRM5KMT2AHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108779295-A Nitrile rubber composition and rubber crosslinked material 日本瑞翁株式会社 2018-11-09 — — CN disclosed
CN-106574082-B Crosslinkable nitrile rubber composition and crosslinked rubber 日本瑞翁株式会社 2018-10-30 — — CN disclosed
CN-108473724-A Nitrile rubber composition, crosslinkable nitrile rubber composition, and rubber crosslinked product 日本瑞翁株式会社 2018-08-31 — — CN disclosed
CN-106103571-B Composition for dip forming and dip-formed molding 日本瑞翁株式会社 2018-08-28 — — CN disclosed
CN-108431097-A The manufacturing method of composition for thermoplastic elastomer 日本瑞翁株式会社 2018-08-21 — — CN disclosed
CN-108350229-A Rubber cross object 日本瑞翁株式会社 2018-07-31 — — CN disclosed
CN-107922679-A Nitrile rubber composition, crosslinkable nitrile rubber composition, and rubber crosslinked product 日本瑞翁株式会社 2018-04-17 — — CN disclosed
CN-105934474-B Cross-linkable nitrile rubber composition and rubber cross thing 日本瑞翁株式会社 2018-04-10 — — CN disclosed
CN-107849314-A Nitrile rubber composition and rubber cross thing 日本瑞翁株式会社 2018-03-27 — — CN disclosed
CN-106029768-B Crosslinkable rubber composition and method for producing crosslinked rubber 日本瑞翁株式会社 2018-02-02 — — CN disclosed
CN-107614552-A The high saturated copolymer rubber of nitrile group-containing 日本瑞翁株式会社 2018-01-19 — — CN disclosed
CN-107531852-A The high saturated copolymer rubber of nitrile group-containing 日本瑞翁株式会社 2018-01-02 — — CN disclosed
CN-106103569-B nitrile copolymer rubber composition 日本瑞翁株式会社 2017-12-05 — — CN disclosed
CN-107428998-A Nitrile rubber composition and rubber crosslinked product 日本瑞翁株式会社 2017-12-01 — — CN disclosed
CN-107406630-A Nitrile rubber composition and rubber crosslinked product 日本瑞翁株式会社 2017-11-28 — — CN disclosed
CN-107075182-A Rubber cross thing 日本瑞翁株式会社 2017-08-18 — — CN disclosed
CN-107001715-A Nitrile rubber composition, latex composition of highly saturated nitrile rubber, and rubber crosslinked product 日本瑞翁株式会社 2017-08-01 — — CN disclosed
CN-107001720-A Crosslinkable nitrile rubber composition and crosslinked rubber 日本瑞翁株式会社 2017-08-01 — — CN disclosed
CN-106795333-A Crosslinkable nitrile rubber composition and crosslinked rubber 日本瑞翁株式会社 2017-05-31 — — CN disclosed
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