SCHEMBL27711864

SCHEMBL27711864

O=C1NC(=O)c2c1ccc(CC1CO1)c2CC1CO1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ MAPK10 P53779 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ PPOX P50336 1/20 0.32
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ WEE1 P30291 1/20 0.30

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
SCHEMBL27835175 0.85 PARP1 (0.40) PARP1KDM4EALDH1A1HPGDMAPK10
SCHEMBL27815639 0.84 PARP1 (0.39) PARP1KDM4EALDH1A1HPGDMAPK10
SCHEMBL27815645 0.84 PARP1 (0.39) PARP1KDM4EALDH1A1HPGDMAPK10
SCHEMBL476301 0.80 KDM4E (0.40) PARP1KDM4EALDH1A1HPGDMAPK10
SCHEMBL3882337 0.80 KDM4E (0.40) PARP1KDM4EALDH1A1HPGDMAPK10
SCHEMBL30614595 0.80 KDM4E (0.40) PARP1KDM4EALDH1A1HPGDMAPK10
SCHEMBL932859 0.80 KDM4E (0.40) PARP1KDM4EALDH1A1HPGDMAPK10
SCHEMBL28192768 0.79 CYP3A4 (0.37) PARP1ALDH1A1MAOAMAOB
Methane SCHEMBL28294512 0.79 KDM4E (0.40) PARP1KDM4EALDH1A1HPGDMAPK10
SCHEMBL27815634 0.75 GSK3B (0.39) PARP1

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
CN-104516199-A Photosensitive resin manufacture method and color filter SHOWA DENKO KK 2015-04-15 — — CN disclosed
CN-104422743-A Separation and detection method for anticoagulant drugs GUANGDONG HEC PHARMACEUTICAL 2015-03-18 — — CN disclosed
CN-101046674-A Holographic recording medium TOSHIBA KK (JP) 2007-10-03 — — CN disclosed
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