SCHEMBL19986069

SCHEMBL19986069

c1cc(-c2cccc3c2oc2ccccc23)cc(-n2c3ccccc3c3c4c5ccccc5c5ccccc5c4c4c5ccccc5oc4c32)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.45
GGPS1 O95749 1/20 0.40
PRKDC P78527 5/20 0.37
PTGES2 Q9H7Z7 1/20 0.37
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
ATM Q13315 1/20 0.33
RXFP1 Q9HBX9 2/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
PPARG P37231 1/20 0.32
NR2E3 Q9Y5X4 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
CDC14B O60729 1/20 0.32
CDC14A Q9UNH5 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL19986089 0.92 ALOX5 (0.36) ALOX5GGPS1PRKDCPTGES2PRMT5
SCHEMBL19986049 0.90 ALOX5 (0.34) ALOX5GGPS1RXFP1ALDH1A1LMNA
SCHEMBL19986062 0.89 KDM4E (0.35) ALOX5ATMRXFP1ALDH1A1LMNA
SCHEMBL19986054 0.89 KDM4E (0.35) ALOX5GGPS1PTGES2ATMRXFP1
SCHEMBL19986094 0.89 ALOX5 (0.34) ALOX5GGPS1RXFP1ALDH1A1LMNA
SCHEMBL19986067 0.89 ALOX5 (0.44) ALOX5GGPS1PRKDCPTGES2PRMT5
SCHEMBL19986057 0.89 ALDH1A1 (0.34) ATMRXFP1ALDH1A1LMNAPPARG
SCHEMBL19986031 0.88 ALDH1A1 (0.33) ALOX5RXFP1ALDH1A1LMNAPPARG
SCHEMBL19986008 0.87 PLA2G2A (0.35) ATMRXFP1ALDH1A1LMNAPPARG
SCHEMBL19986025 0.87 PLA2G2A (0.35) ALOX5ATMRXFP1ALDH1A1LMNA

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
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed