SCHEMBL3963170

SCHEMBL3963170

Sc1ncc(-c2ccco2)o1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 6/20 0.43
HSD17B10 Q99714 6/20 0.43
HPGD P15428 5/20 0.43
MAPT P10636 4/20 0.43
POLB P06746 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
PKM P14618 2/20 0.43
ALOX15 P16050 2/20 0.43
CASP1 P29466 2/20 0.43
PTPN7 P35236 2/20 0.43
RECQL P46063 2/20 0.43
BLM P54132 2/20 0.43
CASP7 P55210 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL4153138 0.76 ALDH1A1 (0.43) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL4153141 0.76 ALDH1A1 (0.43) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL1799678 0.72 ALDH1A1 (0.63) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL4148373 0.72 NOTUM (0.59) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL12091036 0.72 FAAH (0.43) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL27752608 0.72 RAB9A (0.41) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL4142795 0.72 FAAH (0.40) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL7021994 0.71 ALOX15 (0.59) ALDH1A1KDM4EHSD17B10HPGDMEN1
SCHEMBL13744593 0.69 FAAH (0.44) ALDH1A1KDM4EHSD17B10HPGDMAPT
SCHEMBL13484386 0.68 FAAH (0.43) ALDH1A1KDM4EHSD17B10HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079734-A1 OXADIAZOLE AND THIADIAZOLE COMPOUNDS AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS NeuroSearch A/S (DK) 2009-07-22 EP disclosed
WO-2008049864-A1 OXADIAZOLE AND THIADIAZOLE COMPOUNDS AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS NEUROSEARCH A/S (DK) 2008-05-02 WO disclosed