SCHEMBL6374841

SCHEMBL6374841

CC(C)(C)c1ccc(-c2nnc(-c3cccc4ccccc34)s2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
KDM4E B2RXH2 3/20 0.51
TNF P01375 1/20 0.51
NOD1 Q9Y239 1/20 0.51
CCR4 P51679 1/20 0.47
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
PTPN11 Q06124 1/20 0.43
LMNA P02545 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 1/20 0.43
NR1I2 O75469 1/20 0.41
ADRA2A P08913 1/20 0.41
CYP2D6 P10635 1/20 0.41
ACHE P22303 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2A P28223 1/20 0.41

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
SCHEMBL12914308 0.97 TNF (0.49) NPC1RAB9AKDM4ETNFNOD1
SCHEMBL30987378 0.83 PTPN11 (0.47) NPC1RAB9AKDM4ETNFALDH1A1
SCHEMBL251035 0.81 KDM4E (0.53) NPC1RAB9AKDM4EALDH1A1PTPN11
SCHEMBL1023160 0.80 PPARG (0.53) CCR4LMNANR1I2ADRA2ACYP2D6
SCHEMBL9341530 0.79 PTPN11 (0.45) NPC1RAB9AKDM4EALDH1A1PTPN11
SCHEMBL14062423 0.79 NPC1 (0.75) NPC1RAB9AKDM4ETNFNOD1
SCHEMBL7805156 0.79 NPC1 (0.75) NPC1RAB9AKDM4ETNFNOD1
SCHEMBL1107947 0.79 KDM4E (0.38) NPC1RAB9AKDM4ETNFNOD1
SCHEMBL6303218 0.78 NPC1 (0.64) NPC1RAB9AKDM4ETNFNOD1
SCHEMBL12914313 0.78 PTPN11 (0.50) NPC1RAB9AKDM4EALDH1A1PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6908638-B2 Organic electroluminescent element and method of manufacturing same MINOLTA CO., LTD. (JP) 2005-06-21 US disclosed
US-20010033347-A1 Display element and layered type display element MINOLTA CO., LTD. 2001-10-25 US disclosed
US-20010003601-A1 ORGANIC ELECTROLUMINECENT ELEMENT AND METHOD OF MANUFACTURING SAME MINOLTA CO., LTD. (JP) 2001-06-14 US disclosed
US-6180217-B1 Organic electroluminescent element MINOLTA CO., LTD. (JP) 2001-01-30 US disclosed
US-6060826-A Organic electroluminescent element having an excimer light irradiated positive electrode and method of manufacturing the same MINOLTA CO., LTD. (JP) 2000-05-09 US disclosed