SCHEMBL31233161

SCHEMBL31233161

Cc1ccc(C=CC(=O)c2ccc(N=[N+]=[N-])cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.69
▸ MAOB P27338 7/20 0.61
▸ MAOA P21397 4/20 0.61
▸ POLB P06746 1/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ ALDH1A1 P00352 3/20 0.59
▸ CYP1B1 Q16678 2/20 0.59
▸ HPGD P15428 2/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP1A1 P04798 1/20 0.56
▸ PKM P14618 2/20 0.50
▸ HTT P42858 2/20 0.50
▸ ATM Q13315 2/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.50
▸ NLRP1 Q9C000 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ NTSR1 P30989 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL30383830 1.00 MAPT (0.69) MAPTMAOBMAOAPOLBRAB9A
SCHEMBL13810583 0.93 F3 (0.56) MAPTMAOBMAOAPOLBRAB9A
SCHEMBL30383969 0.93 F3 (0.56) MAPTMAOBMAOAPOLBRAB9A
SCHEMBL28232076 0.93 F3 (0.56) MAPTMAOBMAOAPOLBRAB9A
SCHEMBL25199638 0.87 F3 (0.68) MAPTMAOBMAOAPOLBRAB9A
SCHEMBL25202043 0.87 F3 (0.68) MAPTMAOBMAOAPOLBRAB9A
SCHEMBL25209444 0.87 F3 (0.50) MAPTMAOBMAOARAB9AALDH1A1
SCHEMBL19896763 0.85 CYP1B1 (0.62) MAPTMAOBMAOARAB9AALDH1A1
SCHEMBL21708800 0.85 MAPT (0.62) MAPTMAOBMAOARAB9AALDH1A1
SCHEMBL15518409 0.85 MAPT (0.62) MAPTMAOBMAOARAB9AALDH1A1

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
WO-2024233598-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2024-11-14 — — WO disclosed
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