SCHEMBL19986089

SCHEMBL19986089

c1cc(-c2cccc3oc4ccccc4c23)cc(-n2c3ccccc3c3c4c5ccccc5c5ccccc5c4c4c5ccccc5oc4c32)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
RXFP1 Q9HBX9 2/20 0.32
ALDH1A1 P00352 2/20 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
GGPS1 O95749 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
BRCA1 P38398 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PRMT5 O14744 1/20 0.30
WDR77 Q9BQA1 1/20 0.30
TP53 P04637 1/20 0.30
CDC14B O60729 1/20 0.30
CDC14A Q9UNH5 1/20 0.30

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
SCHEMBL19986054 0.92 KDM4E (0.35) ALOX5RXFP1ALDH1A1LMNAPPARG
SCHEMBL19986069 0.92 ALOX5 (0.45) ALOX5RXFP1ALDH1A1LMNAPPARG
SCHEMBL19986049 0.91 ALOX5 (0.34) ALOX5RXFP1ALDH1A1LMNAPPARG
SCHEMBL19986094 0.90 ALOX5 (0.34) ALOX5RXFP1ALDH1A1LMNAPPARG
SCHEMBL19986062 0.90 KDM4E (0.35) ALOX5RXFP1ALDH1A1LMNAPPARG
SCHEMBL19986097 0.90 BRDT (0.35) ALOX5
SCHEMBL19986057 0.90 ALDH1A1 (0.34) RXFP1ALDH1A1LMNAPPARGNR2E3
SCHEMBL19986031 0.89 ALDH1A1 (0.33) ALOX5RXFP1ALDH1A1LMNAPPARG
SCHEMBL19986008 0.88 PLA2G2A (0.35) RXFP1ALDH1A1LMNAPPARGNR2E3
SCHEMBL19986025 0.88 PLA2G2A (0.35) ALOX5RXFP1ALDH1A1LMNAPPARG

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