SCHEMBL8230516

SCHEMBL8230516

C=C(Nc1cccc2c1C(=O)OC2=O)c1ccc(Cl)s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK33 Q9BYT3 1/20 0.39
HPGD P15428 7/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 7/20 0.36
NPC1 O15118 6/20 0.36
RAB9A P51151 6/20 0.36
LMNA P02545 1/20 0.36
F2 P00734 1/20 0.34
DAO P14920 1/20 0.34
MEN1 O00255 6/20 0.34
KDM4E B2RXH2 3/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
F10 P00742 1/20 0.33
TSHR P16473 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
SCHEMBL3380643 0.86 HPGD (0.53) STK33HPGDSMN1; SMN2ALDH1A1KMT2A
SCHEMBL17590085 0.73 MAOA (0.44) HPGDSMN1; SMN2ALDH1A1RAB9AKDM4E
SCHEMBL1245083 0.72 HPGD (0.47) STK33HPGDSMN1; SMN2ALDH1A1KMT2A
SCHEMBL8231854 0.72 HDAC1 (0.39) STK33HPGDSMN1; SMN2ALDH1A1KMT2A
SCHEMBL1244988 0.70 NPC1 (0.51) STK33HPGDSMN1; SMN2ALDH1A1KMT2A
SCHEMBL8229717 0.70 AHR (0.40) F2F10MAPK1
SCHEMBL303302 0.68 MAOA (0.61) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL29860722 0.68 MAOA (0.61) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL15580925 0.68 MAOA (0.61) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL1245014 0.68 KMT2A (0.51) STK33HPGDSMN1; SMN2ALDH1A1KMT2A

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-2029586-B1 ISOINDOLIN-1-ONE-, ISOINDOLIN-3-ONE- AND ISOINDOLIN-1,3-DIONE-DERIVATIVES AND USE THEREOF BAYER SCHERING PHARMA AG (DE) 2010-11-24 EP disclosed
WO-2007137790-A1 ISOINDOLIN-1-ONE-, ISOINDOLIN-3-ONE- AND ISOINDOLIN-1,3-DIONE-DERIVATIVES AND USE THEREOF BAYER HEALTHCARE AG (DE) 2007-12-06 WO disclosed