SCHEMBL13645724

SCHEMBL13645724

c1ccc(-c2c3ccccc3c(-c3ccccc3)c3c(-c4ccc(-c5nc6ccccc6o5)cc4)c4ccccc4c(-c4ccc(-c5nc6ccccc6o5)cc4)c23)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.59
RAB9A P51151 5/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
ATM Q13315 1/20 0.59
HPGD P15428 5/20 0.55
HSD17B10 Q99714 4/20 0.55
ALDH1A1 P00352 4/20 0.55
KDM4E B2RXH2 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
TP53 P04637 1/20 0.55
ELANE P08246 1/20 0.53
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
MMP8 P22894 1/20 0.52
MMP13 P45452 1/20 0.52
MAPT P10636 3/20 0.50
PTPN2 P17706 1/20 0.50
PTPN1 P18031 1/20 0.50
PTPN5 P54829 1/20 0.50

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
SCHEMBL1925604 0.94 NPC1 (0.63) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13620964 0.92 NPC1 (0.61) NPC1RAB9AMEN1KMT2AATM
SCHEMBL4360878 0.92 NPC1 (0.61) NPC1RAB9AMEN1KMT2AATM
SCHEMBL27365149 0.90 NPC1 (0.67) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13621077 0.90 NPC1 (0.52) NPC1RAB9AMEN1KMT2AATM
SCHEMBL22205293 0.87 NPC1 (0.54) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13621076 0.87 NPC1 (0.49) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13621073 0.87 NPC1 (0.49) NPC1RAB9AMEN1KMT2AATM
SCHEMBL11953885 0.85 NPC1 (0.54) NPC1RAB9AMEN1KMT2AATM
SCHEMBL17384484 0.85 NPC1 (0.54) NPC1RAB9AMEN1KMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7598666-B2 Organic electroluminescent device and luminescent material SANYO ELECTRIC CO., LTD. (JP) 2009-10-06 US disclosed
US-7598666-B2 Organic electroluminescent device and luminescent material SANYO ELECTRIC CO., LTD. (JP) 2009-10-06 US disclosed