SCHEMBL17460809

SCHEMBL17460809

Cc1ccc2c(c1)Cc1cc(N)ccc1C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
MAPT P10636 3/20 0.48
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
LMNA P02545 2/20 0.48
KDM4E B2RXH2 2/20 0.48
NPC1 O15118 1/20 0.48
HPGD P15428 1/20 0.48
ACHE P22303 1/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TLR9 Q9NR96 1/20 0.41
METAP1 P53582 2/20 0.40
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 2/20 0.39
ALOX15 P16050 2/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL15308827 1.00 ALDH1A1 (0.48) ALDH1A1MAPTRAB9ASMN1; SMN2LMNA
SCHEMBL9973088 0.89 MAPT (0.62) ALDH1A1MAPTRAB9ASMN1; SMN2LMNA
SCHEMBL6901119 0.86 METAP1 (0.48) ALDH1A1MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL6905206 0.86 METAP1 (0.48) ALDH1A1MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL31196693 0.86 METAP1 (0.48) ALDH1A1MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL3779423 0.86 MAPT (0.60) ALDH1A1MAPTRAB9ASMN1; SMN2LMNA
SCHEMBL11950500 0.86 MAPT (0.60) ALDH1A1MAPTRAB9ASMN1; SMN2LMNA
SCHEMBL14174122 0.86 MAPT (0.58) ALDH1A1MAPTRAB9ASMN1; SMN2LMNA
Ammonia Solution, Strong SCHEMBL28721468 0.84
SCHEMBL16573110 0.82 ALDH1A1 (0.40) ALDH1A1MAPTRAB9ASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9244309-B2 Vertical alignment layer and liquid crystal display including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-01-26 US disclosed