SCHEMBL27963148

SCHEMBL27963148

O=COC(Cc1ccc([N+](=O)[O-])cc1)Cc1cc(-c2ccccc2)n[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ XBP1 P17861 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ PSD A5PKW4 2/20 0.36
▸ PTPRF P10586 1/20 0.36
▸ PTPN2 P17706 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ PTPN11 Q06124 1/20 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
SCHEMBL27963156 0.90 MAPT (0.53) MAPTMEN1KMT2ATDP1SMN1; SMN2
SCHEMBL27963119 0.88 LMNA (0.45) LMNAPOLBRAB9APTPN1CYP11B1
SCHEMBL27963122 0.81 MME (0.42) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL28030908 0.80 CPA1 (0.46) MAPTMEN1KMT2ATDP1SMN1; SMN2
SCHEMBL27963175 0.79 CYP11B1 (0.38) MAPTLMNAPOLBRAB9APTPN1
SCHEMBL27963121 0.79 MAPT (0.42) MAPTMEN1KMT2ATDP1NPC1
SCHEMBL28172139 0.78 CYP11B1 (0.52) MAPTMEN1KMT2ATDP1SMN1; SMN2
SCHEMBL27677335 0.76 MEN1 (0.40) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL29110788 0.74 MAPT (0.51) MAPTMEN1KMT2ATDP1SMN1; SMN2
SCHEMBL27815972 0.72 LMNA (0.38) MAPTMEN1KMT2ASMN1; SMN2LMNA

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
CN-103787976-A 1-aryl-3-aryl-1H-pyrromonazole-5-hydroximic acid derivative and application thereof UNIV SHANDONG 2014-05-14 — — CN disclosed
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