SCHEMBL7354934

SCHEMBL7354934

COc1ccc(C2Sc3ccccc3NCC2=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.56
MAPT P10636 5/20 0.44
LMNA P02545 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPK1 P28482 2/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 1/20 0.44
TNKS2 Q9H2K2 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 2/20 0.39
NPC1 O15118 1/20 0.39
MAOA P21397 1/20 0.39
PTGS2 P35354 1/20 0.39
RAB9A P51151 1/20 0.39
GSK3B P49841 1/20 0.39
THRB P10828 1/20 0.39

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
Oxalic Acid SCHEMBL7398720 0.93 SLC2A1 (0.50) SLC2A1MAPTLMNAMEN1KMT2A
Fumaric Acid SCHEMBL8801680 0.91 SLC2A1 (0.48) SLC2A1MAPTLMNAMEN1KMT2A
SCHEMBL4539804 0.77 SLC2A1 (0.63) SLC2A1MAPTLMNAMEN1KMT2A
SCHEMBL10742386 0.73 SLC2A1 (0.56) SLC2A1MAPTLMNAMEN1KMT2A
SCHEMBL9602657 0.72 SMN1; SMN2 (0.72) SLC2A1MAPTMEN1KMT2AMAPK1
SCHEMBL7419513 0.72 SLC2A1 (0.43) SLC2A1MAPTLMNAMEN1KMT2A
SCHEMBL9848234 0.72 SLC2A1 (0.43) SLC2A1MAPTLMNAMEN1KMT2A
SCHEMBL10983954 0.72 MAPT (0.61) SLC2A1MAPTLMNAKMT2AMAPK1
SCHEMBL24071112 0.70 SLC2A1 (0.48) SLC2A1MAPTLMNAMEN1KMT2A
SCHEMBL7348790 0.68 HSD17B10 (0.73) SLC2A1MAPTLMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1087953-A1 NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES NICOX S.A. (FR) 2001-04-04 EP claimed
WO-1999067231-A1 NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES NICOX S.A. (FR) 1999-12-29 WO claimed
EP-1087953-A1 NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES NICOX S.A. (FR) 2001-04-04 EP disclosed
WO-1999067231-A1 NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES NICOX S.A. (FR) 1999-12-29 WO disclosed
EP-0154895-A2 New sulfonic resins having a therapeutical activity, preparation thereof and pharmaceutical compositions containing them ISTITUTO LUSO FARMACO D'ITALIA S.p.A. (IT) 1985-09-18 EP disclosed