SCHEMBL7657396

SCHEMBL7657396

O=c1c(O)c(C2=COC(Cc3ccccc3)O2)oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 2/20 0.41
PTPN1 P18031 2/20 0.41
PTPN5 P54829 2/20 0.41
MAPT P10636 5/20 0.40
TP53 P04637 4/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PGAM1 P18669 1/20 0.40
ALDH1A1 P00352 3/20 0.38
PKM P14618 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
AR P10275 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
HSP90AA1 P07900 1/20 0.37

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
SCHEMBL7659448 0.92 TP53 (0.37) PTPN2PTPN1PTPN5MAPTTP53
SCHEMBL7665046 0.92 HIF1A (0.42) PTPN2PTPN1PTPN5MAPTTP53
SCHEMBL7658172 0.91 HIF1A (0.44) PTPN2PTPN1PTPN5MAPTTP53
SCHEMBL7858188 0.91 TDP1 (0.45) PTPN1MAPTTP53THRBSMN1; SMN2
SCHEMBL7657829 0.90 MEN1 (0.38) PTPN2PTPN1PTPN5MAPTTP53
SCHEMBL7654281 0.89 HIF1A (0.45) PTPN2PTPN1PTPN5MAPTTP53
SCHEMBL7656711 0.87 HIF1A (0.44) PTPN2PTPN1PTPN5MAPTTP53
SCHEMBL7660123 0.86 HSPD1 (0.47) PTPN2PTPN1PTPN5MAPTSMN1; SMN2
SCHEMBL7651988 0.85 KDM4E (0.41) MAPTTP53ALDH1A1PKMKDM4E
SCHEMBL7855840 0.84 PNMT (0.42) MAPTTP53THRBSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6500846-B1 2-(4-CHLOROPHENYL)-7-METHOXYCHROMEN-4-ONE, AS CYCLIN-DEPENDENT KINASE INHIBITORS, USED AS ANTICARCINOGENIC AGENTS OR FOR PROPHYLAXIS OF NEURODEGENERATIVE DISEASE LG CHEMICAL, LTD. (KR) 2002-12-31 US disclosed