SCHEMBL19986202

SCHEMBL19986202

c1ccc(-c2ccc(-c3cc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)nc4cnccc34)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
EGFR P00533 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
DHODH Q02127 1/20 0.33
CYP11B1 P15538 2/20 0.31
CYP17A1 P05093 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP11B2 P19099 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL19986128 0.98 KDM4E (0.35) KDM4EALDH1A1HPGDLMNAHTT
SCHEMBL19986129 0.95 KDM4E (0.32) KDM4EALDH1A1HPGDLMNAHTT
SCHEMBL19986136 0.92 EGFR (0.40) KDM4EALDH1A1HPGDLMNAHTT
SCHEMBL19986145 0.90 EGFR (0.42) KDM4EALDH1A1HPGDLMNAHTT
SCHEMBL19986149 0.86 KDM4E (0.37) KDM4EALDH1A1HPGDLMNAHTT
SCHEMBL19039945 0.85 EGFR (0.42) KDM4EALDH1A1HPGDLMNAHTT
SCHEMBL19997999 0.84 EGFR (0.38) KDM4EALDH1A1HPGDLMNAHTT
SCHEMBL19986203 0.84 TOP1 (0.41) KDM4EALDH1A1HPGDLMNAHTT
SCHEMBL19986131 0.83 DHODH (0.33) KDM4EALDH1A1HPGDDHODHCYP11B1
SCHEMBL18805448 0.83 EGFR (0.43) KDM4EALDH1A1HPGDLMNAHTT

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