SCHEMBL22919940

SCHEMBL22919940

Ic1cccc2c1oc1cc(-c3ccccc3)ccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.40
DYRK1A Q13627 1/20 0.40
PRKDC P78527 2/20 0.38
PLA2G2A P14555 4/20 0.38
PLA2G4A P47712 4/20 0.38
MMP12 P39900 1/20 0.38
MMP13 P45452 1/20 0.38
PTPN2 P17706 2/20 0.36
PTPN1 P18031 2/20 0.36
HCRTR1 O43613 1/20 0.36
PLA2G10 O15496 1/20 0.35
AHR P35869 1/20 0.35
PGR P06401 1/20 0.35
PTPRF P10586 1/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 2/20 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
SCHEMBL1637813 0.84 PLA2G2A (0.42) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL1637390 0.84 PRKDC (0.44) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL13564016 0.84 DYRK1A (0.47) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL24090393 0.83 PLA2G2A (0.50) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL19108694 0.83 PLA2G2A (0.47) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL16984634 0.83 PLA2G2A (0.47) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL1636398 0.81 PRKDC (0.42) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL16283931 0.81 MAOA (0.45) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL28363313 0.81 ALOX5 (0.40) ALOX5DYRK1APRKDCPLA2G2APLA2G4A
SCHEMBL24969295 0.81 TTR (0.49) ALOX5DYRK1APRKDCPLA2G2APLA2G4A

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
EP-3770166-B1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2021-10-06 EP disclosed
EP-3770166-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2021-01-27 EP disclosed