SCHEMBL21973763

SCHEMBL21973763

c1ccc(N(c2ccc3c(c2)oc2ccccc23)c2ccc3c(c2)sc2c(N(c4ccccc4)c4ccc5c(c4)oc4ccccc45)cccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.36
MAPT P10636 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
NPC1 O15118 2/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TTR P02766 1/20 0.32
MAOA P21397 1/20 0.31
ESR2 Q92731 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
PRKDC P78527 1/20 0.30

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
SCHEMBL21966413 1.00 AHR (0.36) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL21966677 0.96 MAPT (0.34) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL24700802 0.96 MAPT (0.35) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL21966514 0.95 AHR (0.33) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL21966411 0.95 AHR (0.33) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL21966412 0.94 LIMK1 (0.33) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL22506052 0.93 ESR2 (0.34) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL26342815 0.93 AHR (0.35) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL24000685 0.92 AHR (0.40) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL24700952 0.92 LIMK1 (0.32) AHRMAPTMEN1KMT2AKDM4E

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-20200144510-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-05-07 US disclosed