SCHEMBL4453092

SCHEMBL4453092

C=C(C)C(=O)Oc1ccc2nn(-c3ccccc3O)nc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.43
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 4/20 0.40
KMT2A Q03164 6/20 0.38
ATM Q13315 1/20 0.38
IGF2BP2 Q9Y6M1 1/20 0.37
MAPT P10636 6/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
MEN1 O00255 3/20 0.34
RXFP1 Q9HBX9 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
APAF1 O14727 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL4444924 0.88 NPC1 (0.45) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL29382372 0.88 NPC1 (0.45) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL29384504 0.88 NPC1 (0.52) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL93326 0.88 NPC1 (0.52) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL4439833 0.86 NPC1 (0.54) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL8600147 0.86 ALDH1A1 (0.39) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL28880295 0.86 NPC1 (0.39) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL4441549 0.85 IGF2BP2 (0.39) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL4438709 0.83 NPC1 (0.37) ELANENPC1RAB9ALMNAALDH1A1
SCHEMBL5178883 0.82 NPC1 (0.39) ELANENPC1RAB9ALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1256611-B1 Aqueous dispersion and coated product JSR CORP (JP) 2009-07-29 EP disclosed
US-6726997-B2 WWATERPROOF, HARDNESS, RATION TRANSPARENT; PROTECTIVE COATINGS JSR CORPORATION (JP) 2004-04-27 US disclosed
US-20030073779-A1 Aqueous dispersion and coated product JSR CORPORATION (JP) 2003-04-17 US disclosed
EP-1256611-A2 Aqueous dispersion and coated product JSR Corporation (JP) 2002-11-13 EP disclosed
EP-0407932-B1 UV light-absorbing skin-protecting composition SHIONOGI & CO (JP) 1995-05-24 EP disclosed
US-5063048-A Acrylic ester or amide polymers SHIONOGI & CO., LTD. (JP) 1991-11-05 US disclosed
EP-0407932-A2 UV light-absorbing skin-protecting composition SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1991-01-16 EP disclosed