SCHEMBL18654154

SCHEMBL18654154

IOc1ccccc1-c1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.50
LMNA P02545 3/20 0.50
CCR1 P32246 2/20 0.50
CCR5 P51681 2/20 0.50
CCR8 P51685 2/20 0.50
CYP1A2 P05177 1/20 0.50
POLB P06746 1/20 0.50
METAP1 P53582 1/20 0.50
BLM P54132 1/20 0.50
HIF1A Q16665 1/20 0.50
DOHH Q9BU89 1/20 0.50
P4HTM Q9NXG6 1/20 0.50
ADRA1D P25100 1/20 0.49
ADRA1A P35348 1/20 0.49
ADRA1B P35368 1/20 0.49
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
GRM4 Q14833 1/20 0.43
NPC1 O15118 6/20 0.43

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
SCHEMBL18654155 0.88 KDM4E (0.60) KDM4ELMNACCR1CCR5CCR8
SCHEMBL7196588 0.83 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL24677590 0.80 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL29496935 0.80 SMN1; SMN2 (0.62) KDM4ELMNACCR1CCR5CCR8
SCHEMBL18976884 0.80 KDM4E (0.50) KDM4ELMNACCR1CCR5CCR8
SCHEMBL2039527 0.80 SMN1; SMN2 (0.62) KDM4ELMNACCR1CCR5CCR8
SCHEMBL858806 0.78 KDM4E (0.72) KDM4ELMNACCR1CCR5CCR8
SCHEMBL10801186 0.77 ADRA1A (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL22122698 0.77 KDM4E (0.53) KDM4ELMNACCR1CCR5CCR8
SCHEMBL2194879 0.77 GRM5 (0.51) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3232490-B1 ORGANIC LIGHT EMITTING DIODE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER NOVALED GMBH (DE) 2021-03-17 EP disclosed
US-9972792-B2 Electron transport layer and film having improved thermal stability ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2018-05-15 US disclosed
US-20170084847-A1 ELECTRON TRANSPORT LAYER AND FILM HAVING IMPROVED THERMAL STABILITY ROHM AND HAAS ELECTRONIC MATERIALS LLC 2017-03-23 US disclosed