SCHEMBL29785331

SCHEMBL29785331

COc1ccc(Cl)cc1-c1ncc(Cl)nc1N

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
RECQL P46063 1/20 0.48
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
AGPAT2 O15120 13/20 0.46
HRH4 Q9H3N8 1/20 0.42
MAPKAPK2 P49137 1/20 0.41
SCN2A Q99250 1/20 0.41

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
SCHEMBL20339056 1.00 ALDH1A1 (0.51) ALDH1A1KDM4ERECQLMEN1LMNA
SCHEMBL20339204 0.89 ALDH1A1 (0.51) ALDH1A1KDM4ERECQLMEN1LMNA
SCHEMBL29785340 0.89 ALDH1A1 (0.51) ALDH1A1KDM4ERECQLMEN1LMNA
SCHEMBL19876494 0.77 ALDH1A1 (0.51) ALDH1A1KDM4ERECQLMEN1LMNA
SCHEMBL1743659 0.76 ALDH1A1 (0.52) ALDH1A1KDM4ERECQLMEN1LMNA
SCHEMBL3663018 0.72 ALDH1A1 (0.49) ALDH1A1KDM4ERECQLMEN1LMNA
SCHEMBL7699644 0.72 ALDH1A1 (0.56) ALDH1A1KDM4ERECQLMEN1LMNA
SCHEMBL931552 0.71 ALDH1A1 (0.55) ALDH1A1KDM4ERECQLMEN1LMNA
SCHEMBL2416618 0.71 SCN2A (0.67) ALDH1A1KDM4ERECQLAGPAT2MAPKAPK2
SCHEMBL929779 0.71 ALDH1A1 (0.55) ALDH1A1KDM4ERECQLMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115275032-A Light-emitting element, organic compound, light-emitting device, electronic device, and lighting device 株式会社半导体能源研究所 2022-11-01 CN disclosed
CN-110073510-B Light-emitting element, organic compound, light-emitting device, electronic device, and lighting device 株式会社半导体能源研究所 2022-07-19 CN disclosed