SCHEMBL13053007

SCHEMBL13053007

Cc1c(-c2nc3cccnc3s2)c(C)c(-c2nc3cccnc3s2)c(C)c1-c1nc2cccnc2s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.52
RAB9A P51151 4/20 0.52
PDK1 Q15118 1/20 0.51
ALDH1A1 P00352 5/20 0.50
LMNA P02545 3/20 0.50
HTT P42858 3/20 0.50
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 3/20 0.49
KDM4E B2RXH2 5/20 0.48
GAA P10253 2/20 0.48
GLA P06280 1/20 0.48
RUNX1 Q01196 1/20 0.48
CBFB Q13951 1/20 0.48
MAPT P10636 4/20 0.47
TP53 P04637 2/20 0.47
MAPK1 P28482 1/20 0.46
AHR P35869 1/20 0.44
ALOX15 P16050 1/20 0.44
THRB P10828 1/20 0.44

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
SCHEMBL13052988 0.96 NPC1 (0.52) NPC1RAB9APDK1ALDH1A1LMNA
SCHEMBL13052980 0.89 NPC1 (0.49) NPC1RAB9APDK1ALDH1A1LMNA
SCHEMBL13310867 0.89 PDK1 (0.58) NPC1RAB9APDK1ALDH1A1LMNA
SCHEMBL13052956 0.85 NPC1 (0.56) NPC1RAB9APDK1ALDH1A1LMNA
SCHEMBL14406440 0.79 KDM4E (0.59) NPC1RAB9AALDH1A1LMNAHTT
SCHEMBL13998714 0.79 KDM4E (0.58) NPC1RAB9APDK1ALDH1A1LMNA
SCHEMBL13053004 0.78 PDK1 (0.55) NPC1RAB9APDK1ALDH1A1LMNA
SCHEMBL13998684 0.78 KDM4E (0.61) NPC1RAB9APDK1ALDH1A1LMNA
SCHEMBL686571 0.78 ILK (0.65)
SCHEMBL2176039 0.77 PDK1 (0.58) NPC1RAB9APDK1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2224790-B1 Light emitting element and azole compound UDC IRELAND LTD (IE) 2013-01-02 EP disclosed
US-7838131-B2 Light emitting element and azole compound FUJIFILM CORPORATION (JP) 2010-11-23 US disclosed
US-7838131-B2 Light emitting element and azole compound FUJIFILM CORPORATION (JP) 2010-11-23 US disclosed
EP-2224790-A1 Light emitting element and azole compound Fujifilm Corporation (JP) 2010-09-01 EP disclosed
US-7740956-B2 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2010-06-22 US disclosed
US-7740956-B2 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2010-06-22 US disclosed
US-20100044638-A1 1,3,5-Tri((2-(methyl-)benzimidazol-1-yl)-)benzene; OLED'shaving a light emission maximum wavelength of 500 nm or less wherein the minimum excitation triplet energy level of the host material is higher than the minimum excitation triplet energy level of the light emitting material FUJIFILM CORPORATION (JP) 2010-02-25 US disclosed
US-20100044638-A1 1,3,5-Tri((2-(methyl-)benzimidazol-1-yl)-)benzene; OLED'shaving a light emission maximum wavelength of 500 nm or less wherein the minimum excitation triplet energy level of the host material is higher than the minimum excitation triplet energy level of the light emitting material FUJIFILM CORPORATION (JP) 2010-02-25 US disclosed
US-7632579-B2 Light emitting element and azole compound FUJIFILM CORPORATION (JP) 2009-12-15 US disclosed
US-7632579-B2 Light emitting element and azole compound FUJIFILM CORPORATION (JP) 2009-12-15 US disclosed