SCHEMBL15469827

SCHEMBL15469827

c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)Oc4ccccc4N5c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 6/20 0.32
FAAH O00519 1/20 0.32
MGLL Q99685 1/20 0.32
PTPN1 P18031 1/20 0.32
CDK8 P49336 1/20 0.31
PDE6D O43924 1/20 0.31
P2RX1 P51575 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ELANE P08246 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
SCHEMBL15469815 1.00 P2RX4 (0.32) P2RX4FAAHMGLLPTPN1CDK8
SCHEMBL15469843 1.00 P2RX4 (0.32) P2RX4FAAHMGLLPTPN1CDK8
SCHEMBL15469761 0.99 P2RX4 (0.31) P2RX4FAAHMGLLPTPN1CDK8
SCHEMBL15469844 0.99 FAAH (0.34) P2RX4FAAHMGLLPTPN1CDK8
SCHEMBL15469758 0.99 P2RX4 (0.31) P2RX4FAAHMGLLPTPN1CDK8
SCHEMBL15672198 0.97 FAAH (0.33) P2RX4FAAHMGLLPTPN1CDK8
SCHEMBL15469931 0.97 FAAH (0.31) P2RX4FAAHMGLLPTPN1CDK8
SCHEMBL13125120 0.97 P2RX4 (0.32) P2RX4CDK8P2RX1MAPTSMN1; SMN2
SCHEMBL15469832 0.96 FAAH (0.33) P2RX4FAAHMGLLPDE6D
SCHEMBL15469783 0.95 FAAH (0.33) FAAHMGLLPDE6D

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