SCHEMBL9287352

SCHEMBL9287352

O=C1c2ccccc2C(=Cc2ccc([N+](=O)[O-])cc2)c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.62
APP P05067 4/20 0.62
SNCA P37840 4/20 0.62
SMN1; SMN2 Q16637 1/20 0.57
CASP3 P42574 1/20 0.57
RAB9A P51151 1/20 0.57
SENP8 Q96LD8 1/20 0.57
SENP7 Q9BQF6 1/20 0.57
SENP6 Q9GZR1 1/20 0.57
METAP1 P53582 1/20 0.55
PTPRC P08575 2/20 0.51
BCHE P06276 1/20 0.51
ACHE P22303 1/20 0.51
CES1 P23141 1/20 0.51
S100A4 P26447 1/20 0.51
USP18 Q9UMW8 2/20 0.49
UCHL5 Q9Y5K5 2/20 0.49
HSP90AA1 P07900 1/20 0.49
USP2 O75604 1/20 0.49
ALDH1A1 P00352 1/20 0.48

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
SCHEMBL11274474 0.92 MAPT (0.64) MAPTAPPSNCASMN1; SMN2CASP3
SCHEMBL28647928 0.91 MAPT (0.63) MAPTAPPSNCASMN1; SMN2CASP3
SCHEMBL7152082 0.82 MAPT (0.57) MAPTAPPSNCASMN1; SMN2CASP3
SCHEMBL27477775 0.82 PTPRC (0.71) MAPTSMN1; SMN2RAB9APTPRCBCHE
SCHEMBL8078175 0.79 MAPT (0.51) MAPTAPPSNCASMN1; SMN2CASP3
SCHEMBL4726286 0.78 TUBB4A (0.65) MAPTALDH1A1KMT2AL3MBTL1MAOB
Anthraquinone SCHEMBL7764505 0.78 ALDH1A1 (0.73) MAPTPTPRCBCHEACHECES1
SCHEMBL28974744 0.78 PTPRC (0.61) MAPTAPPSNCASMN1; SMN2CASP3
SCHEMBL28974742 0.78 PTPRC (0.61) MAPTAPPSNCASMN1; SMN2CASP3
SCHEMBL1703195 0.78 BAX (0.66) MAPTAPPSNCAMETAP1PTPRC

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
EP-0664780-A1 10-SUBSTITUTED 1,8-DIHYDROXY-9(10H) ANTHRACENONE PHARMACEUTICALS TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1995-08-02 EP claimed