SCHEMBL22992000

SCHEMBL22992000

Bc1cccc(-c2ccc3oc4cc5ccccc5cc4c3c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.40
PLA2G4A P47712 4/20 0.40
PLA2G10 O15496 1/20 0.38
CASP3 P42574 2/20 0.35
SENP7 Q9BQF6 2/20 0.35
SENP6 Q9GZR1 2/20 0.35
KDM4E B2RXH2 5/20 0.35
MAPT P10636 4/20 0.35
HPGD P15428 4/20 0.35
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34

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
SCHEMBL12834666 0.85 MAPT (0.49) PLA2G2APLA2G4APLA2G10CASP3SENP7
SCHEMBL27452246 0.84 PLA2G2A (0.43) PLA2G2APLA2G4APLA2G10KDM4EMAPT
SCHEMBL16067916 0.83 KDM4E (0.40) KDM4EMAPTHPGDALDH1A1TSHR
SCHEMBL16067498 0.81 MAOB (0.50) PLA2G2APLA2G4AKDM4EMAPTALDH1A1
SCHEMBL27383769 0.81 MAPT (0.49) PLA2G2APLA2G4AKDM4EMAPTHPGD
SCHEMBL22992128 0.81 HPGD (0.38) PLA2G2APLA2G4ACASP3SENP7SENP6
SCHEMBL24404293 0.80 PLA2G2A (0.43) PLA2G2APLA2G4APLA2G10KDM4EMAPT
SCHEMBL19916939 0.80 PLA2G2A (0.43) PLA2G2APLA2G4APLA2G10KDM4EMAPT
SCHEMBL21450844 0.79 PLA2G2A (0.41) PLA2G2APLA2G4APLA2G10CASP3SENP7
SCHEMBL26010882 0.79 PLA2G2A (0.38) PLA2G2APLA2G4APLA2G10CASP3SENP7

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
WO-2021029598-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-18 WO disclosed