SCHEMBL11286304

SCHEMBL11286304

CCCCCCC1C/C(=C/c2ccc(N)cc2)C(=O)/C(=C/c2ccc(N)cc2)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.44
GRM2 Q14416 1/20 0.42
MAPT P10636 4/20 0.41
HTT P42858 3/20 0.41
LMNA P02545 3/20 0.41
HSP90AA1 P07900 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP19A1 P11511 5/20 0.40
NPC1 O15118 1/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAOB P27338 1/20 0.36
CYP1A2 P05177 1/20 0.36
F2 P00734 4/20 0.36

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
SCHEMBL11286309 1.00 DRD3 (0.44) DRD3GRM2MAPTHTTLMNA
SCHEMBL11289839 0.99 DRD3 (0.45) DRD3GRM2MAPTHTTLMNA
SCHEMBL11289837 0.99 DRD3 (0.45) DRD3GRM2MAPTHTTLMNA
SCHEMBL10979321 0.89 MAPT (0.45) DRD3MAPTHTTLMNAHSP90AA1
SCHEMBL10977689 0.89 MAPT (0.45) DRD3MAPTHTTLMNAHSP90AA1
SCHEMBL10977512 0.83 MAPT (0.57) DRD3MAPTHTTLMNAHSP90AA1
SCHEMBL18415114 0.83 MAPT (0.57) DRD3MAPTHTTLMNAHSP90AA1
SCHEMBL10977516 0.83 MAPT (0.57) DRD3MAPTHTTLMNAHSP90AA1
SCHEMBL11286592 0.77 MAPT (0.42) MAPTHTTLMNAHSP90AA1RAB9A
SCHEMBL11286596 0.77 MAPT (0.42) MAPTHTTLMNAHSP90AA1RAB9A

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-4354976-A Process for the preparation of azidobenzal compounds MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1982-10-19 US disclosed