SCHEMBL20172254

SCHEMBL20172254

Sc1ccc2oc3ncccc3c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 4/20 0.40
NPC1 O15118 2/20 0.40
NCOA1 Q15788 1/20 0.38
PIK3CA P42336 1/20 0.34
KMT2A Q03164 5/20 0.33
MEN1 O00255 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 2/20 0.33
RAB9A P51151 2/20 0.33
IGF1R P08069 4/20 0.33
EGFR P00533 3/20 0.33
FLT4 P35916 2/20 0.33
KDR P35968 2/20 0.33
PDE4D Q08499 2/20 0.32
PSMD14 O00487 1/20 0.32
COPS5 Q92905 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSP90AA1 P07900 2/20 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
SCHEMBL15836007 0.81 KDM4E (0.53) KDM4EALDH1A1MAPTNPC1NCOA1
SCHEMBL15835993 0.81 KDM4E (0.53) KDM4EALDH1A1MAPTNPC1NCOA1
SCHEMBL19721151 0.79 KDM4E (0.51) KDM4EALDH1A1MAPTNPC1NCOA1
SCHEMBL21568385 0.79 KDM4E (0.51) KDM4EALDH1A1MAPTNPC1NCOA1
SCHEMBL3666822 0.79 ALDH1A1 (0.51) KDM4EALDH1A1MAPTNPC1KMT2A
SCHEMBL18015444 0.79 KDM4E (0.51) KDM4EALDH1A1MAPTNPC1NCOA1
SCHEMBL20172259 0.79 NPC1 (0.58) KDM4EALDH1A1MAPTNPC1NCOA1
SCHEMBL22138626 0.79 KDM4E (0.51) KDM4EALDH1A1MAPTNPC1NCOA1
SCHEMBL13509560 0.79 ALDH1A1 (0.51) KDM4EALDH1A1MAPTNPC1NCOA1
SCHEMBL15624398 0.78 KDM4E (0.50) KDM4EALDH1A1MAPTNPC1NCOA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3339395-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2019-10-02 EP disclosed
EP-3339395-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2018-06-27 EP disclosed
EP-2980182-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2018-05-23 EP disclosed