SCHEMBL13911024

SCHEMBL13911024

c1ccc(-c2nnc(-c3c(-c4nnc(-c5ccccc5)c5ccccc45)c(-c4nnc(-c5ccccc5)c5ccccc45)c(-c4nnc(-c5ccccc5)c5ccccc45)c(-c4nnc(-c5ccccc5)c5ccccc45)c3-c3nnc(-c4ccccc4)c4ccccc34)c3ccccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.54
LMNA P02545 3/20 0.54
ALDH1A1 P00352 9/20 0.50
NPSR1 Q6W5P4 7/20 0.49
KMT2A Q03164 5/20 0.49
MAPT P10636 4/20 0.49
MEN1 O00255 4/20 0.49
ATM Q13315 1/20 0.47
HPGD P15428 4/20 0.45
KDM4E B2RXH2 2/20 0.45
ALPL P05186 1/20 0.45
GAA P10253 1/20 0.45
IDO1 P14902 1/20 0.45
TTK P33981 1/20 0.45
MAPK10 P53779 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
PDE5A O76074 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45

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
SCHEMBL4864061 0.92 HTT (0.60) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL13457926 0.87 HTT (0.56) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL13911030 0.85 HTT (0.54) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL13911027 0.81 HTT (0.50) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL7657206 0.79 HTT (0.48) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL31132418 0.79 KDM4E (0.65) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL580414 0.79 MAPT (0.49) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL7068103 0.79 ALDH1A1 (0.53) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL7664718 0.79 NPSR1 (0.49) HTTLMNAALDH1A1NPSR1KMT2A
SCHEMBL219856 0.79 KDM4E (0.65) HTTLMNAALDH1A1NPSR1KMT2A

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
US-8703300-B2 Organic electroluminescent element, display and illuminator KONICA MINOLTA HOLDINGS, INC. (JP) 2014-04-22 US disclosed
US-8703300-B2 Organic electroluminescent element, display and illuminator KONICA MINOLTA HOLDINGS, INC. (JP) 2014-04-22 US disclosed
US-20090072715-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY AND ILLUMINATOR KONICA MINOLTA HOLDINGS, INC. (JP) 2009-03-19 US disclosed