SCHEMBL8096908

SCHEMBL8096908

[c]1occc1-c1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
LMNA P02545 1/20 0.43
PABPC1 P11940 1/20 0.40
APOBEC3A P31941 1/20 0.40
EIF4H Q15056 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
TP53 P04637 1/20 0.38
PKM P14618 1/20 0.38
NOTUM Q6P988 1/20 0.37
PTK2 Q05397 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
DDAH1 O94760 1/20 0.33
NOS1 P29475 1/20 0.33
ATAD2 Q6PL18 1/20 0.33
DYRK1A Q13627 1/20 0.33
KIF11 P52732 2/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32

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
SCHEMBL39593 0.76 ALDH1A1 (0.38) LMNATP53NPC1RAB9ASMN1; SMN2
SCHEMBL11456086 0.73 ESR1 (0.43) MAPTLMNATP53PKMNPC1
SCHEMBL5535944 0.73 NPC1 (0.37) LMNATP53NOTUMNPC1RAB9A
SCHEMBL5538900 0.72 KIF11 (0.43) NOTUMKIF11TSHRALDH1A1
SCHEMBL8096259 0.70 CYP2A6 (0.40) MAPTCYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL1238312 0.68 CYP2A6 (0.31) KDM4EALDH1A1
Bromide SCHEMBL31703446 0.68 MAPT (0.92) MAPTLMNAPABPC1APOBEC3AEIF4H
Bromide SCHEMBL28440104 0.68 MAPT (0.92) MAPTLMNAPABPC1APOBEC3AEIF4H
Bromide SCHEMBL10568427 0.68 MAPT (0.92) MAPTLMNAPABPC1APOBEC3AEIF4H
Bromide SCHEMBL26683959 0.68 MAPT (0.92) MAPTLMNAPABPC1APOBEC3AEIF4H

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 7 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
EP-2757881-A1 KAPPA OPIOID RECEPTOR EFFECTORS AND USES THEREOF The University of Kansas (US) 2014-07-30 EP disclosed
WO-2013040321-A1 KAPPA OPIOID RECEPTOR EFFECTORS AND USES THEREOF UNIVERSITY OF KANSAS (US) 2013-03-21 WO disclosed
US-6063956-A APPLYING FUNGICIDE OR INSECTICIDE TO THE LOCUS WHERE CONTROL IS DESIRED ROHM AND HAAS COMPANY (US) 2000-05-16 US disclosed