SCHEMBL10695582

SCHEMBL10695582

CCCCCCCCOc1cccc2nc(-c3ccccc3)[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 3/20 0.46
TLR8 Q9NR97 2/20 0.46
PDE4A P27815 2/20 0.46
PDE4B Q07343 2/20 0.46
PDE4C Q08493 2/20 0.46
PDE4D Q08499 2/20 0.46
XDH P47989 1/20 0.44
MCHR1 Q99705 2/20 0.43
ATP4A P20648 1/20 0.43
ATP4B P51164 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL28160736 0.91 PDE5A (0.46) PDE5ATLR8PDE4APDE4BPDE4C
SCHEMBL10695579 0.80 PDE5A (0.57) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL21017804 0.78 ACHE (0.52) ATP4AATP4B
SCHEMBL28027631 0.78 TNKS (0.54) NPC1RAB9ALMNAKDM4EALDH1A1
SCHEMBL7553361 0.77 NPC1 (0.53) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL5970052 0.73 TSHR (0.55) LMNAKDM4EALDH1A1TP53TSHR
SCHEMBL38656506 0.73 PDE5A (0.72) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9320573 0.73 ATP4A (0.74) ATP4AATP4BNPC1RAB9AKDM4E
SCHEMBL9094859 0.72 HDAC3 (0.68) ATP4AATP4BNPC1RAB9ALMNA
SCHEMBL20982645 0.72 ACHE (0.46) ATP4AATP4BNPC1RAB9AKDM4E

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
EP-0251760-A2 Rubber composition Bridgestone Corporation (JP) 1988-01-07 EP disclosed