SCHEMBL28460619

SCHEMBL28460619

OB(O)c1cccc(-c2cc3c4ccccc4oc3c3ccccc23)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.49
▸ MGLL Q99685 1/20 0.47
▸ GGPS1 O95749 1/20 0.42
▸ DYRK1A Q13627 1/20 0.39
▸ PTGES2 Q9H7Z7 1/20 0.39
▸ AHR P35869 1/20 0.39
▸ ENPP2 Q13822 2/20 0.39
▸ PLG P00747 1/20 0.35
▸ F12 P00748 1/20 0.35
▸ F11 P03951 1/20 0.35
▸ KLKB1 P03952 1/20 0.35
▸ PRSS1 P07477 1/20 0.35
▸ PRSS2 P07478 1/20 0.35
▸ PRSS3 P35030 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ PRKDC P78527 1/20 0.34
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 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
SCHEMBL283154 0.90 ALOX5 (0.61) ALOX5MGLLGGPS1PTGES2AHR
SCHEMBL30980094 0.90 ALOX5 (0.61) ALOX5MGLLGGPS1PTGES2AHR
SCHEMBL31286372 0.79 MGLL (0.50) ALOX5MGLLGGPS1DYRK1AENPP2
SCHEMBL15387100 0.79 MGLL (0.50) ALOX5MGLLGGPS1DYRK1AENPP2
SCHEMBL21102243 0.79 ALOX5 (0.58) ALOX5MGLLGGPS1DYRK1APTGES2
SCHEMBL10122709 0.79 ALOX5 (0.50) ALOX5GGPS1DYRK1APTGES2AHR
SCHEMBL15667357 0.79 MGLL (0.46) ALOX5MGLLGGPS1AHRENPP2
SCHEMBL24665443 0.78 ALOX5 (0.47) ALOX5MGLLGGPS1DYRK1APTGES2
SCHEMBL9109516 0.78 GABRP (0.52) ALOX5GGPS1DYRK1APTGES2AHR
SCHEMBL12983694 0.78 ALOX5 (0.49) ALOX5GGPS1DYRK1APTGES2AHR

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-111601800-B Compound and organic light emitting device comprising the same 株式会社LG化学 2024-01-09 — — CN disclosed
CN-111601800-A Compound and organic light emitting device including the same 株式会社LG化学 2020-08-28 — — CN disclosed
Send feedback