SCHEMBL29698485

SCHEMBL29698485

OB(O)c1ccc(-c2ccccn2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.54
LMNA P02545 3/20 0.54
P4HTM Q9NXG6 3/20 0.54
CCR1 P32246 3/20 0.54
CCR5 P51681 3/20 0.54
CCR8 P51685 3/20 0.54
CYP1A2 P05177 1/20 0.54
POLB P06746 1/20 0.54
METAP1 P53582 1/20 0.54
BLM P54132 1/20 0.54
HIF1A Q16665 1/20 0.54
DOHH Q9BU89 1/20 0.54
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
TP53 P04637 3/20 0.52
ALOX15 P16050 2/20 0.52
HTT P42858 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
ALDH1A1 P00352 1/20 0.52

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
SCHEMBL2597518 1.00 KDM4E (0.54) KDM4ELMNAP4HTMCCR1CCR5
SCHEMBL23331924 0.86 CA1 (0.50) KDM4ELMNAP4HTMCCR1CCR5
SCHEMBL38656446 0.85 ENPP2 (0.42) KDM4EP4HTMCCR1CCR5CCR8
SCHEMBL26314552 0.85 ENPP2 (0.42) KDM4EP4HTMCCR1CCR5CCR8
Dipyridyl SCHEMBL29080660 0.82 KDM4E (0.61) KDM4ELMNAP4HTMCCR1CCR5
SCHEMBL2558899 0.81 KDM4E (0.52) KDM4ELMNAP4HTMCCR1CCR5
Dipyridyl SCHEMBL15453735 0.79 KDM4E (0.78) KDM4ELMNAP4HTMCCR1CCR5
Dipyridyl SCHEMBL27886181 0.79 KDM4E (0.78) KDM4ELMNAP4HTMCCR1CCR5
SCHEMBL29950578 0.78 MGLL (0.54) HPGDSCA4CA6CA5ACA7
SCHEMBL1370915 0.78 CA1 (0.54) KDM4ELMNAP4HTMCCR1CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113651809-B Organic electroluminescent device and compound for organic electroluminescent device 三星显示有限公司 2025-03-25 CN disclosed
CN-114605433-B Indenothiophene dioxide structure-containing organic material and application thereof 北京燕化集联光电技术有限公司 2024-02-27 CN disclosed
CN-113200998-B Organic luminescent material and application thereof 武汉市晟承宇科技有限公司 2023-07-11 CN disclosed
CN-113173934-B Organic compound, application thereof and organic electroluminescent device 武汉市晟承宇科技有限公司 2023-05-19 CN disclosed
CN-114605433-A Organic material containing indenothiophene dioxide structure and application thereof 北京燕化集联光电技术有限公司 2022-06-10 CN disclosed