SCHEMBL10692517

SCHEMBL10692517

O=C1c2ccc(Br)cc2Cc2ccc(Cl)cc21

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.56
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TDP2 O95551 1/20 0.46
S100A4 P26447 3/20 0.46
MAOA P21397 4/20 0.41
MAOB P27338 3/20 0.41
ITGA1 P56199 1/20 0.40
HSP90AA1 P07900 1/20 0.40
BCL2 P10415 1/20 0.40
MCL1 Q07820 1/20 0.40
PARP10 Q53GL7 2/20 0.39
F7 P08709 1/20 0.39
PARP1 P09874 1/20 0.39
F3 P13726 1/20 0.39
PARP11 Q9NR21 1/20 0.39
PPOX P50336 1/20 0.38
CMA1 P23946 2/20 0.38
AHR P35869 2/20 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
SCHEMBL27761880 0.88 METAP1 (0.65) METAP1TDP1L3MBTL1TDP2S100A4
SCHEMBL6905130 0.88 METAP1 (0.65) METAP1TDP2S100A4MAOAMAOB
SCHEMBL23294539 0.86 METAP1 (0.44) METAP1TDP2S100A4ITGA1HSP90AA1
SCHEMBL4254618 0.86 METAP1 (0.71) METAP1TDP1L3MBTL1TDP2S100A4
SCHEMBL24730416 0.82 CHEK2 (0.47) METAP1TDP1L3MBTL1TDP2S100A4
SCHEMBL6018153 0.82 METAP1 (0.47) METAP1TDP2HSP90AA1PARP10PARP11
SCHEMBL5345106 0.82 TDP1 (0.66) METAP1TDP1L3MBTL1S100A4MAOA
SCHEMBL10691369 0.82 METAP1 (0.71) METAP1TDP2S100A4MAOAMAOB
SCHEMBL10057541 0.82 TDP1 (0.63) METAP1TDP1L3MBTL1TDP2S100A4
SCHEMBL6899110 0.81 MAOA (0.67) METAP1TDP1L3MBTL1S100A4MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4792551-A 9-anthryloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0132351-A2 9-Anthryloxyaminoalkanes and related compounds, processes for their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-01-30 EP disclosed