SCHEMBL12577909

SCHEMBL12577909

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5cccc6c5oc5ccccc56)c5ccccc5c(-c5cccc6c5oc5ccccc56)c4c3)cc21

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.44
PRKDC P78527 4/20 0.39
PGR P06401 1/20 0.36
GGPS1 O95749 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP2C19 P33261 1/20 0.34
AVPR1A P37288 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.32
ATM Q13315 1/20 0.32
PDK2 Q15119 2/20 0.32
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
CDC25C P30307 1/20 0.32
MAPT P10636 1/20 0.32
HDAC8 Q9BY41 1/20 0.31

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
SCHEMBL13488111 0.98 ALOX5 (0.43) ALOX5PRKDCPGRGGPS1MEN1
SCHEMBL13487343 0.96 ALOX5 (0.41) ALOX5PRKDCPGRGGPS1MEN1
SCHEMBL13487888 0.95 ALOX5 (0.40) ALOX5PRKDCPGRGGPS1MEN1
SCHEMBL13487739 0.95 ALOX5 (0.40) ALOX5PRKDCPGRGGPS1MEN1
SCHEMBL13488041 0.92 ALOX5 (0.38) ALOX5PRKDCPGRGGPS1
SCHEMBL13487962 0.91 ALOX5 (0.41) ALOX5PRKDCPGRGGPS1MEN1
SCHEMBL13488347 0.90 ALOX5 (0.40) ALOX5PRKDCPGRGGPS1MEN1
SCHEMBL13487802 0.90 ALOX5 (0.40) ALOX5PRKDCPGRGGPS1MEN1
SCHEMBL10442776 0.89 ALOX5 (0.45) ALOX5PRKDCPGRGGPS1MEN1
SCHEMBL16017825 0.89 ALOX5 (0.56) ALOX5PRKDCPGRGGPS1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210336149-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2021-10-28 US disclosed
US-20110156016-A1 ORGANIC LIGHT-EMITTING MEDIUM AND ORGANIC EL ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2011-06-30 US disclosed
US-20110156016-A1 ORGANIC LIGHT-EMITTING MEDIUM AND ORGANIC EL ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2011-06-30 US disclosed