SCHEMBL12651095

SCHEMBL12651095

C=C(C)C(=O)NCc1cc(C(C)(C)c2ccccc2)c(O)c(C(C)(C)c2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.39
▸ LMNA P02545 3/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ ALDH1A1 P00352 6/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ RIPK1 Q13546 1/20 0.37
▸ ESRRG P62508 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ KIF11 P52732 1/20 0.36
▸ EGFR P00533 1/20 0.36
▸ AGTR1 P30556 1/20 0.35
▸ HTT P42858 1/20 0.35

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
SCHEMBL12662924 0.84 ALDH1A1 (0.39) GAALMNARAB9ASMN1; SMN2ALDH1A1
SCHEMBL4330346 0.82 GAA (0.51) GAALMNAALDH1A1MEN1KMT2A
SCHEMBL183463 0.75 ALDH1A1 (0.59) GAASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL5534319 0.73 ERCC1 (0.42) GAALMNAALDH1A1KMT2AMAPT
Methacrylic Acid SCHEMBL28898117 0.73 ALDH1A1 (0.56) GAASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL20239098 0.73 SELL (0.43) GAALMNAALDH1A1MAPTKDM4E
SCHEMBL207449 0.71 MEN1 (0.41) GAALMNAALDH1A1MEN1KMT2A
SCHEMBL11339375 0.71 ALDH1A1 (0.44) GAALMNAALDH1A1MEN1KMT2A
SCHEMBL730868 0.71 POLB (0.53) LMNASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL11556141 0.70 PTPN1 (0.52) GAAALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796865-B2 Curable liquids and inks for toys and food packaging applications AGFA GRAPHICS NV (BE) 2017-10-24 — — US disclosed
US-9416287-B2 Curable liquids and inks for toys and food packaging applications AGFA GRAPHICS NV (BE) 2016-08-16 — — US disclosed
US-9416287-B2 Curable liquids and inks for toys and food packaging applications AGFA GRAPHICS NV (BE) 2016-08-16 — — US disclosed
US-9249321-B2 Curable liquids and inks for toys and food packaging applications AGFA GRAPHICS NV (BE) 2016-02-02 — — US disclosed
US-20150050427-A1 CURABLE LIQUIDS AND INKS FOR TOYS AND FOOD PACKAGING APPLICATIONS AGFA NV (BE) 2015-02-19 — — US disclosed
US-8940811-B2 Curable liquids and inks for toys and food packaging applications AGFA GRAPHICS NV (BE) 2015-01-27 — — US disclosed
US-8940811-B2 Curable liquids and inks for toys and food packaging applications AGFA GRAPHICS NV (BE) 2015-01-27 — — US disclosed
US-20140050858-A1 CURABLE LIQUIDS AND INKS FOR TOYS AND FOOD PACKAGING APPLICATIONS AGFA GRAPHICS NV (BE) 2014-02-20 — — US disclosed
US-8563624-B2 Curable liquids and inks for toys and food packaging applications AGFA GRAPHICS NV (BE) 2013-10-22 — — US disclosed
US-20130236654-A1 CURABLE LIQUIDS AND INKS FOR TOYS AND FOOD PACKAGING APPLICATIONS AGFA GRAPHICS NV (BE) 2013-09-12 — — US disclosed
US-20130236654-A1 CURABLE LIQUIDS AND INKS FOR TOYS AND FOOD PACKAGING APPLICATIONS AGFA GRAPHICS NV (BE) 2013-09-12 — — US disclosed
US-20110124768-A1 CURABLE LIQUIDS AND INKS FOR TOYS AND FOOD PACKAGING APPLICATIONS AGFA GRAPHICS NV (BE) 2011-05-26 — — US disclosed
US-20100313782-A1 CURABLE LIQUIDS AND INKS FOR TOYS AND FOOD PACKAGING APPLICATIONS AGFA GRAPHICS NV (BE) 2010-12-16 — — US disclosed
US-20100313782-A1 CURABLE LIQUIDS AND INKS FOR TOYS AND FOOD PACKAGING APPLICATIONS AGFA GRAPHICS NV (BE) 2010-12-16 — — US disclosed
EP-2053103-B1 Curable liquids and inks for toys and food packaging applications AGFA GRAPHICS NV (BE) 2010-10-06 — — EP disclosed
WO-2009053305-A1 CURABLE LIQUIDS AND INKS FOR TOYS AND FOOD PACKAGING APPLICATIONS AGFA GRAPHICS NV (BE) 2009-04-30 — — WO disclosed
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