SCHEMBL4449676

SCHEMBL4449676

C=C(C)C(=O)Nc1ccc(-n2nc3ccccc3n2)c(O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
POLB P06746 6/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 3/20 0.44
USP2 O75604 1/20 0.44
NPC1 O15118 6/20 0.43
RAB9A P51151 6/20 0.43
LMNA P02545 2/20 0.43
BAZ1A Q9NRL2 1/20 0.42
KDM4E B2RXH2 6/20 0.41
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
RECQL P46063 2/20 0.40
BLM P54132 2/20 0.40
PABPC1 P11940 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
SCHEMBL4453094 0.90 RAB9A (0.52) TDP1POLBMEN1KMT2AMAPT
SCHEMBL320934 0.88 NPC1 (0.47) TDP1POLBMEN1KMT2AMAPT
SCHEMBL10441377 0.87 MEN1 (0.56) POLBMEN1KMT2AMAPTUSP2
SCHEMBL14017586 0.81 NOX1 (0.48) POLBMEN1KMT2AMAPTUSP2
SCHEMBL4451036 0.80 NPC1 (0.44) TDP1POLBMEN1KMT2AMAPT
SCHEMBL30887146 0.78 RAB9A (0.54) TDP1POLBMEN1KMT2AMAPT
SCHEMBL3376787 0.78 RAB9A (0.54) TDP1POLBMEN1KMT2AMAPT
SCHEMBL4453728 0.78 TDP1 (0.45) TDP1POLBMEN1KMT2AMAPT
SCHEMBL12955892 0.78 NPC1 (0.51) POLBMEN1KMT2AMAPTUSP2
SCHEMBL508724 0.77 RXFP1 (0.42) TDP1POLBMEN1KMT2AMAPT

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