SCHEMBL15469758

SCHEMBL15469758

c1ccc(-c2ccc(N(c3ccccc3)c3ccc4c(c3)Oc3ccccc3N4c3ccccc3)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 5/20 0.31
FAAH O00519 1/20 0.31
MGLL Q99685 1/20 0.31
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTPN1 P18031 1/20 0.31
CDK8 P49336 1/20 0.31
PDE6D O43924 1/20 0.30
APP P05067 1/20 0.30
P2RX1 P51575 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL15469761 1.00 P2RX4 (0.31) P2RX4FAAHMGLLMAPTKDM4E
SCHEMBL15469843 0.99 P2RX4 (0.32) P2RX4FAAHMGLLMAPTPTPN1
SCHEMBL15469815 0.99 P2RX4 (0.32) P2RX4FAAHMGLLMAPTPTPN1
SCHEMBL15469827 0.99 P2RX4 (0.32) P2RX4FAAHMGLLMAPTPTPN1
SCHEMBL13125120 0.99 P2RX4 (0.32) P2RX4MAPTKDM4EALDH1A1CYP1A2
SCHEMBL15469844 0.97 FAAH (0.34) P2RX4FAAHMGLLMAPTPTPN1
SCHEMBL15469783 0.96 FAAH (0.33) FAAHMGLLALDH1A1PDE6DAPP
SCHEMBL15469883 0.96 P2RX4 (0.31) P2RX4MAPTKDM4EALDH1A1CYP1A2
SCHEMBL15469931 0.96 FAAH (0.31) P2RX4FAAHMGLLALDH1A1PTPN1
SCHEMBL15672198 0.96 FAAH (0.33) P2RX4FAAHMGLLPTPN1CDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed
US-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed