SCHEMBL16352450

SCHEMBL16352450

c1ccc(-c2nc3c4c5ccccc5n(-c5ccccc5)c4c(-c4cccs4)cc3n2-c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.42
▸ HPGD P15428 5/20 0.42
▸ ALDH1A1 P00352 5/20 0.42
▸ POLB P06746 1/20 0.42
▸ HSD17B10 Q99714 2/20 0.40
▸ ESR2 Q92731 2/20 0.38
▸ CCNA2 P20248 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ PLA2G1B P04054 1/20 0.38
▸ ATG4B Q9Y4P1 1/20 0.38
▸ TSHR P16473 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ CHRNE Q04844 1/20 0.36

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
SCHEMBL16352471 0.95 KDM4E (0.48) KDM4EHPGDALDH1A1POLBHSD17B10
SCHEMBL16352410 0.94 KDM4E (0.47) KDM4EHPGDALDH1A1POLBHSD17B10
SCHEMBL16352426 0.87 KDM4E (0.43) KDM4EHPGDALDH1A1POLBHSD17B10
SCHEMBL16352424 0.86 ESR1 (0.40) KDM4EHPGDALDH1A1ESR2L3MBTL1
SCHEMBL16352469 0.84 MAPT (0.42) KDM4EHPGDALDH1A1HSD17B10ESR2
SCHEMBL16352451 0.83 MAPT (0.44) KDM4EHPGDALDH1A1HSD17B10ESR2
SCHEMBL16352473 0.81 KDM4E (0.41) KDM4EHPGDALDH1A1POLBHSD17B10
SCHEMBL16352571 0.78 ESR1 (0.39) KDM4EALDH1A1ESR2L3MBTL1KMT2A
SCHEMBL16352575 0.76 ALDH1A1 (0.40) ALDH1A1POLBKMT2AMEN1LMNA
SCHEMBL16352425 0.76 ALDH1A1 (0.37) KDM4EHPGDALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9419229-B2 Compound, organic optoelectric device including the same and display device including the optoelectric device CHEIL INDUSTRIES, INC. (KR) 2016-08-16 — — US disclosed
US-9419229-B2 Compound, organic optoelectric device including the same and display device including the optoelectric device CHEIL INDUSTRIES, INC. (KR) 2016-08-16 — — US disclosed
US-20140374706-A1 COMPOUND, ORGANIC OPTOELECTRIC DEVICE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE OPTOELECTRIC DEVICE CHEIL INDUSTRIES, INC. (KR) 2014-12-25 — — US disclosed
US-20140374706-A1 COMPOUND, ORGANIC OPTOELECTRIC DEVICE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE OPTOELECTRIC DEVICE CHEIL INDUSTRIES, INC. (KR) 2014-12-25 — — US disclosed
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