SCHEMBL21295952

SCHEMBL21295952

[c]1ccc2occc2c1-c1ccccn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.39
LMNA P02545 3/20 0.39
CCR1 P32246 2/20 0.39
CCR5 P51681 2/20 0.39
CCR8 P51685 2/20 0.39
CYP1A2 P05177 2/20 0.39
POLB P06746 2/20 0.39
METAP1 P53582 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39
DOHH Q9BU89 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
ALDH1A1 P00352 4/20 0.36
RAB9A P51151 8/20 0.35
NPC1 O15118 7/20 0.35
TP53 P04637 6/20 0.35
SMN1; SMN2 Q16637 5/20 0.35
HSD17B10 Q99714 4/20 0.35
PKM P14618 4/20 0.35
TDP1 Q9NUW8 2/20 0.35

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
SCHEMBL21295964 0.75 TP53 (0.40) KDM4ELMNACCR1CCR5CCR8
SCHEMBL21295638 0.75 KDM4E (0.39) KDM4ECYP1A2ALDH1A1HSD17B10HPGD
SCHEMBL21300533 0.74 KDM4E (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL7265635 0.73 KDM4E (0.59) KDM4ELMNACCR1CCR5CCR8
SCHEMBL1033552 0.73 KDM4E (0.48) KDM4ELMNACCR1CCR5CCR8
SCHEMBL21295609 0.72 DYRK1A (0.41) LMNATP53PKMMAPTHTR2C
SCHEMBL21295856 0.71 CYP2A6 (0.41) KDM4ELMNACYP1A2ALDH1A1RAB9A
SCHEMBL21295769 0.71 LMNA (0.42) KDM4ELMNACCR1CCR5CCR8
SCHEMBL21295946 0.71 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL21295733 0.69 KRAS (0.40) KDM4ELMNACCR1CCR5CCR8

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
CN-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 CN disclosed
CN-112912372-A Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2021-06-04 CN disclosed
WO-2020085319-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2020-04-30 WO disclosed
WO-2019163959-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCNET ELEMENT, AND ELECTRON-TRANSPORTING MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2019-08-29 WO disclosed