SCHEMBL15469844

SCHEMBL15469844

c1ccc(-c2ccc(N(c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c3ccc4c(c3)Oc3ccccc3N4c3ccccc3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
PDE6D O43924 1/20 0.33
P2RX4 Q99571 5/20 0.31
PTPN1 P18031 1/20 0.31
CDK8 P49336 1/20 0.31
P2RX1 P51575 1/20 0.30
MAPT P10636 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
SCHEMBL15672198 0.99 FAAH (0.33) FAAHMGLLPDE6DP2RX4PTPN1
SCHEMBL15469843 0.99 P2RX4 (0.32) FAAHMGLLPDE6DP2RX4PTPN1
SCHEMBL15469815 0.99 P2RX4 (0.32) FAAHMGLLPDE6DP2RX4PTPN1
SCHEMBL15469827 0.99 P2RX4 (0.32) FAAHMGLLPDE6DP2RX4PTPN1
SCHEMBL15469761 0.97 P2RX4 (0.31) FAAHMGLLPDE6DP2RX4PTPN1
SCHEMBL15469758 0.97 P2RX4 (0.31) FAAHMGLLPDE6DP2RX4PTPN1
SCHEMBL15469931 0.96 FAAH (0.31) FAAHMGLLP2RX4PTPN1CDK8
SCHEMBL13125120 0.96 P2RX4 (0.32) P2RX4CDK8P2RX1MAPTSMN1; SMN2
SCHEMBL15469832 0.95 FAAH (0.33) FAAHMGLLPDE6DP2RX4
SCHEMBL15469936 0.95 FAAH (0.34) FAAHMGLLPDE6DP2RX4CDK8

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