SCHEMBL7657390

SCHEMBL7657390

O=c1c(O)c(-c2ccc3c(c2)OCO3)oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
HTT P42858 3/20 0.56
KDM4E B2RXH2 3/20 0.56
RAB9A P51151 2/20 0.56
TP53 P04637 2/20 0.56
NPC1 O15118 1/20 0.56
ALOX12 P18054 1/20 0.56
CASP1 P29466 1/20 0.56
CASP7 P55210 1/20 0.56
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HSP90AA1 P07900 1/20 0.48
HSP90AB1 P08238 1/20 0.48
GFER P55789 1/20 0.47
HPGD P15428 2/20 0.46

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
SCHEMBL7659438 0.91 GFER (0.61) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7664966 0.91 MAPT (0.61) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7665040 0.91 MAPT (0.56) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7658164 0.90 MAPT (0.53) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7858184 0.89 MAPT (0.54) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7657823 0.88 MEN1 (0.53) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7654276 0.86 MAPT (0.58) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7663357 0.85 KDM4E (0.52) MAPTMEN1KMT2AKDM4ETP53
SCHEMBL7656710 0.85 MAPT (0.56) MAPTMEN1KMT2AHTTKDM4E
SCHEMBL7660118 0.84 HSP90AA1 (0.53) MAPTMEN1KMT2AHTTKDM4E

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