SCHEMBL20172259

SCHEMBL20172259

Nc1ccc2oc3ncccc3c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.58
SMN1; SMN2 Q16637 7/20 0.58
RAB9A P51151 7/20 0.58
ALDH1A1 P00352 7/20 0.58
MAPT P10636 7/20 0.58
KDM4E B2RXH2 5/20 0.58
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
HPGD P15428 3/20 0.58
MAPK1 P28482 1/20 0.51
EGFR P00533 5/20 0.47
IGF1R P08069 3/20 0.47
GFER P55789 1/20 0.46
TP53 P04637 2/20 0.41
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSD17B10 Q99714 2/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL15485929 0.86 ALDH1A1 (0.56) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL15835993 0.81 KDM4E (0.53) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL15836007 0.81 KDM4E (0.53) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL15631679 0.80 ALDH1A1 (0.45) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL18015444 0.79 KDM4E (0.51) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL21568385 0.79 KDM4E (0.51) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL19721151 0.79 KDM4E (0.51) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL22138626 0.79 KDM4E (0.51) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL13509560 0.79 ALDH1A1 (0.51) NPC1SMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL20172254 0.79 KDM4E (0.51) NPC1SMN1; SMN2RAB9AALDH1A1MAPT

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