SCHEMBL8616264

SCHEMBL8616264

CCCCCCCCN(c1ccc(C=CC(O)(c2ccccc2)c2ccccc2)cc1)c1ccc(C=CC(O)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
KDM4A O75164 4/20 0.38
KDM2A Q9Y2K7 4/20 0.38
NPC1 O15118 1/20 0.37
JAK2 O60674 1/20 0.37
RAB9A P51151 1/20 0.37
PAX8 Q06710 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
EGFR P00533 1/20 0.36
KCNH2 Q12809 2/20 0.36
INSR P06213 1/20 0.35
CNR2 P34972 2/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34

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
SCHEMBL9448703 0.77 RELA (0.59) KDM4ENPC1RAB9AKCNH2
SCHEMBL9448701 0.77 RELA (0.59) KDM4ENPC1RAB9AKCNH2
SCHEMBL10180717 0.76 RAB9A (0.43) NR1H2NR1H3NPC1JAK2RAB9A
SCHEMBL8615630 0.75 BCHE (0.57) NPC1RAB9ABCHEACHE
SCHEMBL7924615 0.74 NPC1 (0.53) NPC1JAK2RAB9APAX8SIGMAR1
SCHEMBL2849795 0.74 NPC1 (0.53) NPC1JAK2RAB9APAX8SIGMAR1
SCHEMBL985190 0.74 NPC1 (0.53) NPC1JAK2RAB9APAX8SIGMAR1
SCHEMBL60682 0.74 NPC1 (0.53) NPC1JAK2RAB9APAX8SIGMAR1
SCHEMBL45379 0.74 NPC1 (0.53) NPC1JAK2RAB9APAX8SIGMAR1
SCHEMBL619876 0.74 NPC1 (0.53) NPC1JAK2RAB9APAX8SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0561562-B1 Heat-sensitive or pressure-sensitive recording material WIGGINS TEAPE GROUP LTD (GB) 1998-05-06 EP disclosed
US-5364830-A Heat or pressure sensitive elements THE WIGGINS TEAPE GROUP LIMITED (GB) 1994-11-15 US disclosed
EP-0561562-A1 Heat-sensitive or pressure-sensitive recording material The Wiggins Teape Group Limited (GB) 1993-09-22 EP disclosed