SCHEMBL28212978

SCHEMBL28212978

Clc1c(-c2ccccc2)nnnc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
MAPT P10636 1/20 0.53
KDM4E B2RXH2 3/20 0.46
HPGD P15428 2/20 0.46
ALDH1A1 P00352 2/20 0.46
GLA P06280 1/20 0.46
PKM P14618 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
XDH P47989 1/20 0.40
CYP1A2 P05177 1/20 0.40
ADORA2B P29275 1/20 0.39

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
SCHEMBL1816352 0.89 LMNA (0.49) LMNAHTTSMN1; SMN2MAPTKDM4E
SCHEMBL7197255 0.78 LMNA (0.56) LMNAHTTSMN1; SMN2MAPTKDM4E
SCHEMBL1898825 0.78 LMNA (0.47) LMNAHTTSMN1; SMN2MAPTKDM4E
SCHEMBL500715 0.77 LMNA (0.56) LMNAHTTSMN1; SMN2MAPTKDM4E
SCHEMBL9138181 0.76 KDM4E (0.47) LMNASMN1; SMN2MAPTKDM4EHPGD
SCHEMBL22360955 0.75 LMNA (0.54) LMNAHTTSMN1; SMN2MAPTKDM4E
SCHEMBL23009764 0.75 KDM4E (0.71) LMNAHTTSMN1; SMN2MAPTKDM4E
SCHEMBL22112418 0.73 MEN1 (0.54) LMNAHTTSMN1; SMN2KDM4EHPGD
Water SCHEMBL28964119 0.73 LMNA (0.52) LMNAHTTSMN1; SMN2MAPTKDM4E
Water SCHEMBL28150223 0.73 LMNA (0.52) LMNAHTTSMN1; SMN2MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110366554-A Novel heterocyclic compound and organic light emitting device using the same 株式会社LG化学 2019-10-22 CN disclosed
CN-105308022-B Condensed fluoranthene compound, material for organic electroluminescent element containing same, and organic electroluminescent element and electronic device using same 出光兴产株式会社 2019-03-15 CN disclosed
CN-104774210-B Fused ring compound and organic luminescent device including it 三星电子株式会社 2019-02-01 CN disclosed
CN-107973786-A Novel compound and organic light-emitting element using same 株式会社LG化学 2018-05-01 CN disclosed
CN-103333167-B Novel nitrogen-containing heterocyclic compound and organic electronic device using the same 株式会社LG化学 2016-08-24 CN disclosed