SCHEMBL8465035

SCHEMBL8465035

O=[N+]([O-])c1ccc(-c2ccc([N+](=O)[O-])cc2O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.60
ALDH1A1 P00352 2/20 0.55
TP53 P04637 1/20 0.55
HPGD P15428 1/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
GAA P10253 1/20 0.53
THRB P10828 1/20 0.53
GYS1 P13807 1/20 0.53
PTPRC P08575 1/20 0.52
S100A4 P26447 1/20 0.52
ERN1 O75460 1/20 0.50
POLB P06746 1/20 0.50
RAB9A P51151 1/20 0.50
BAX Q07812 2/20 0.49
CA9 Q16790 4/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA7 P43166 1/20 0.49

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
SCHEMBL8382506 0.89 POLB (0.64) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL6068096 0.89 LMNA (0.56) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL11028069 0.87 GPR35 (0.69) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL5684890 0.87 ALDH1A1 (0.59) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL9701536 0.86 GPR35 (0.58) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL1539358 0.82 IKBKB (0.56) ALDH1A1HPGDMAPK1GAAGYS1
SCHEMBL12952842 0.81 KMT2A (0.50) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL28239062 0.81 IKBKB (0.54) ALDH1A1HPGDMAPK1GAAGYS1
SCHEMBL1554414 0.80 GPR35 (0.51) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL28592473 0.80 LMNA (0.55) GPR35ALDH1A1TP53HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0641832-B1 Diorganopolysiloxane-Rigid aromatic polymer compositions and preparation thereof DOW CORNING ASIA LTD (JP) 1999-01-13 EP disclosed
EP-0628590-B1 Polyimide having organopolysiloxane side chain DOW CORNING (US) 1998-06-03 EP disclosed
US-5527862-A COMPATIBLE BLENDS; REINFORCED CURED COMPOSITES; HIGH STRENGTH DOW CORNING ASIA, LTD. (JP) 1996-06-18 US disclosed
US-5473041-A Increased solubility and low melting points; separation films; diaminobiphenyl-modified polysiloxanes DOW CORNING CORPORATION (US) 1995-12-05 US disclosed
EP-0641832-A1 Diorganopolysiloxane-Rigid aromatic polymer compositions and preparation thereof DOW CORNING ASIA, Ltd. (JP) 1995-03-08 EP disclosed
EP-0628590-A2 Polyimide having organopolysiloxane side chain DOW CORNING CORPORATION (US) 1994-12-14 EP disclosed