SCHEMBL10594553

SCHEMBL10594553

Clc1cccc2c1c(Cl)cc1[nH]ncc12

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 6/20 0.59
▸ METAP2 P50579 4/20 0.45
▸ TRPA1 O75762 1/20 0.44
▸ MAPK10 P53779 1/20 0.42
▸ RIPK1 Q13546 1/20 0.42
▸ AXL P30530 2/20 0.42
▸ CHEK1 O14757 1/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ PLK3 Q9H4B4 1/20 0.41
▸ HPGD P15428 1/20 0.40
▸ PIM3 Q86V86 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ DYRK1A Q13627 1/20 0.38

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
SCHEMBL10594265 0.81 NOS1 (0.53) NOS1METAP2TRPA1AXLIDO1
SCHEMBL30234107 0.75 NOS1 (1.00) NOS1METAP2TRPA1AXLIDO1
SCHEMBL476854 0.75 NOS1 (1.00) NOS1METAP2TRPA1AXLIDO1
SCHEMBL4314318 0.75 NOS1 (1.00) NOS1METAP2TRPA1AXLIDO1
SCHEMBL10594556 0.74 NOS1 (0.58) NOS1METAP2TRPA1MAPK10RIPK1
SCHEMBL11578011 0.71 NOS1 (0.48) NOS1METAP2TRPA1AXLCHEK1
SCHEMBL10595301 0.68 NOS1 (0.63) NOS1MAPK10RIPK1HPGDPIM3
SCHEMBL21263642 0.68 IDO1 (0.46) NOS1METAP2IDO1POLBKMT2A
SCHEMBL10594461 0.68 METAP2 (0.53) NOS1METAP2TRPA1AXLIDO1
SCHEMBL14487466 0.67 METAP2 (0.56) NOS1METAP2IDO1DYRK1A

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-4871653-A DEVELOPING IN PRESENCE OF MERCAPTO POLYAZAINDENE PROMOTERS AND NUCLEATING QUATERNARY OR HYDRAZIDE-TYPE COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 1989-10-03 — — US disclosed
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