SCHEMBL28879583

SCHEMBL28879583

Nc1ccc(N2c3ccccc3Oc3cccc(N)c32)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 7/20 0.45
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 3/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HSPA1A P0DMV8 1/20 0.32
PABPC1 P11940 1/20 0.32
GAA P10253 2/20 0.32
NPSR1 Q6W5P4 1/20 0.31
USP2 O75604 1/20 0.30
TP53 P04637 1/20 0.30
HTT P42858 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
SCHEMBL17489961 0.90 HSPA1A (0.40) P2RX4SMN1; SMN2KDM4EMAPTMEN1
SCHEMBL8108033 0.86 P2RX4 (0.53) P2RX4SMN1; SMN2NPC1LMNARAB9A
SCHEMBL28335973 0.83 P2RX4 (0.46) P2RX4SMN1; SMN2MAPTNPSR1
SCHEMBL8584047 0.81 P2RX4 (0.49) P2RX4SMN1; SMN2NPC1LMNARAB9A
SCHEMBL24255049 0.77 ALDH1A1 (0.48) P2RX4SMN1; SMN2NPC1LMNARAB9A
SCHEMBL15434761 0.77 MGLL (0.40) P2RX4SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL18389066 0.77 MAPT (0.46) P2RX4SMN1; SMN2NPC1LMNARAB9A
SCHEMBL20308236 0.77 HSPA1A (0.31) P2RX4HSPA1APABPC1
SCHEMBL6123819 0.76 P2RX4 (0.47) P2RX4SMN1; SMN2MAPTNPSR1
SCHEMBL21765588 0.75 GAA (0.45) P2RX4SMN1; SMN2KDM4EMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110437172-A A kind of 3,7- bis- replaces phenoxazine analog derivative and preparation method thereof UNIV ZHENGZHOU 2019-11-12 CN disclosed