SCHEMBL19985908

SCHEMBL19985908

c1ccc2c(c1)sc1c2c2c3ccccc3c3ccccc3c2c2c3ccccc3n(-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c12

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LIMK1 P53667 1/20 0.31
PTPN1 P18031 1/20 0.30
ALOX5 P09917 1/20 0.30
MAPT P10636 2/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL19985962 0.93 ALDH1A1 (0.35) TP53LIMK1ALOX5MAPT
SCHEMBL19986004 0.93 GPR3 (0.33) TP53LIMK1ALOX5MAPT
SCHEMBL19985904 0.92 KDM4E (0.33) TP53KDM4EATML3MBTL1LIMK1
SCHEMBL19985970 0.91 L3MBTL1 (0.37) TP53KDM4EATML3MBTL1LIMK1
SCHEMBL19985919 0.91 L3MBTL1 (0.37) TP53KDM4EATML3MBTL1LIMK1
SCHEMBL19985942 0.91 KDM4E (0.40) TP53KDM4EATML3MBTL1MAPT
SCHEMBL19985916 0.91 KDM4E (0.40) TP53KDM4EATML3MBTL1LIMK1
SCHEMBL19985906 0.91 TP53 (0.30) TP53
SCHEMBL19985932 0.91 MAPT (0.35) TP53LIMK1ALOX5MAPTRXFP1
SCHEMBL19985972 0.90 TP53 (0.35) TP53KDM4EATML3MBTL1PTPN1

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