SCHEMBL12428440

SCHEMBL12428440

CCCCCCCCN1CCCc2cc(C3=C(O)/C(=C4\C(=O)N(c5ccccc5)N=C4C(=O)O)C3=O)ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 3/20 0.37
LMNA P02545 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
CASP1 P29466 1/20 0.37
HTT P42858 1/20 0.37
CASP7 P55210 1/20 0.37
SMAD3 P84022 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PPARG P37231 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
ACHE P22303 1/20 0.35
ADRB2 P07550 8/20 0.34

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
SCHEMBL12428459 0.82 ADRB2 (0.46) MAPTTP53ADRB2ADRB1ADRB3
SCHEMBL12428463 0.81 MEN1 (0.39) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL13866489 0.79 MEN1 (0.35) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL12428243 0.79 PRF1 (0.37) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL12428450 0.79 KMT2A (0.39) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL12428460 0.78 KMT2A (0.39) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL12428462 0.77 KMT2A (0.38) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL12428485 0.77 KMT2A (0.42) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL12428387 0.76 ACHE (0.32) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL12428330 0.74 KMT2A (0.39) MEN1KMT2AALDH1A1MAPTLMNA

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-7977570-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed