SCHEMBL20172378

SCHEMBL20172378

Nc1ccc2c(c1)Oc1cccnc1N2c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPT P10636 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CDK8 P49336 6/20 0.35
NPC1 O15118 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
FGFR1 P11362 1/20 0.35
RAB9A P51151 3/20 0.34
LMNA P02545 2/20 0.34
STAT1 P42224 1/20 0.34
MAPK1 P28482 1/20 0.34
GFER P55789 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
TP53 P04637 2/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL20172210 0.89 NPC1 (0.35) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL20308231 0.84 CDK8 (0.35) KDM4ECDK8
SCHEMBL21415084 0.82 CDK8 (0.38) CDK8
SCHEMBL17489711 0.81 CDK8 (0.41) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL10043567 0.81 MAPT (0.45) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL18389066 0.79 MAPT (0.46) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL29214105 0.77 MAPT (0.40) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL17489707 0.77 CDK8 (0.38) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL20172209 0.76 HSPA1A (0.36) KDM4EALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL17482932 0.76 EGLN1 (0.35) CDK8

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