SCHEMBL10686464

SCHEMBL10686464

Cn1nc(-c2cccc(Br)c2)ccc1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ RAB9A P51151 4/20 0.47
▸ NPC1 O15118 3/20 0.47
▸ HCRTR1 O43613 1/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ SENP8 Q96LD8 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP6 Q9GZR1 1/20 0.47
▸ PARP1 P09874 1/20 0.45
▸ MET P08581 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ RXFP1 Q9HBX9 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HRH3 Q9Y5N1 4/20 0.43
▸ MAPT P10636 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ MAOB P27338 1/20 0.42
▸ IDO1 P14902 1/20 0.41

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
Dimethylamine SCHEMBL10689615 0.95 MEN1 (0.45) MEN1KMT2ARAB9ANPC1HCRTR1
SCHEMBL10684135 0.86 KDM4E (0.42) MEN1KMT2ARAB9ANPC1HCRTR1
SCHEMBL11142730 0.79 KMT2A (0.53) MEN1KMT2ARAB9ASMN1; SMN2KDM4E
SCHEMBL11395117 0.78 HRH3 (0.52) MEN1KMT2ARAB9ANPC1HRH3
SCHEMBL4692622 0.77 RXFP1 (0.47) MEN1KMT2ARAB9ANPC1HCRTR1
SCHEMBL10687571 0.77 MEN1 (0.54) MEN1KMT2ARAB9ANPC1HCRTR1
SCHEMBL17489532 0.77 BRD4 (0.48) METMAOBIDO1
SCHEMBL10681289 0.77 MEN1 (0.54) MEN1KMT2ARAB9ANPC1HCRTR1
SCHEMBL10689612 0.77 MEN1 (0.54) MEN1KMT2ARAB9ANPC1HCRTR1
SCHEMBL11397967 0.76 HRH3 (0.54) MEN1KMT2ARAB9ASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4738961-A FUNGICIDES SANKYO COMPANY, LIMITED (JP) 1988-04-19 — — US disclosed
EP-0072238-B1 PYRIDAZINONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN AGRICULTURAL COMPOSITIONS AND THE TREATMENT OF SEED AND PLANTS SANKYO COMPANY LIMITED (JP) 1985-11-06 — — EP disclosed
EP-0072238-A1 Pyridazinone derivatives, their preparation and their use in agricultural compositions and the treatment of seed and plants SANKYO COMPANY LIMITED (JP) 1983-02-16 — — EP disclosed
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