SCHEMBL7593174

SCHEMBL7593174

Cc1cccc(C=CC=Cc2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.61
RELA Q04206 2/20 0.56
TP53 P04637 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALOX5 P09917 2/20 0.53
PTGS1 P23219 1/20 0.53
PTGS2 P35354 1/20 0.53
NPC1 O15118 3/20 0.52
CASP3 P42574 2/20 0.52
SENP8 Q96LD8 2/20 0.52
SENP7 Q9BQF6 2/20 0.52
SENP6 Q9GZR1 2/20 0.52
FBP1 P09467 1/20 0.52
MAOA P21397 2/20 0.47
EGFR P00533 1/20 0.47
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
PPARG P37231 1/20 0.47
NFE2L2 Q16236 2/20 0.47

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
SCHEMBL7593172 1.00 MAOB (0.61) MAOBRELATP53TDP1ALOX5
SCHEMBL23458000 1.00 MAOB (0.61) MAOBRELATP53TDP1ALOX5
SCHEMBL23457959 0.98 MAOB (0.58) MAOBRELATP53TDP1ALOX5
SCHEMBL23457960 0.98 MAOB (0.58) MAOBRELATP53TDP1ALOX5
SCHEMBL23457950 0.93 TP53 (0.60) MAOBRELATP53TDP1ALOX5
SCHEMBL29862171 0.93 TP53 (0.60) MAOBRELATP53TDP1ALOX5
SCHEMBL1405359 0.91 RELA (0.66) MAOBRELATP53TDP1ALOX5
SCHEMBL29446273 0.91 RELA (0.66) MAOBRELATP53TDP1ALOX5
SCHEMBL318044 0.91 RELA (0.66) MAOBRELATP53TDP1ALOX5
SCHEMBL16105781 0.91 RELA (0.66) MAOBRELATP53TDP1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0796267-B1 IMPROVED PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES DOW CHEMICAL CO (US) 1998-12-02 EP claimed
EP-0796267-A1 IMPROVED PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES THE DOW CHEMICAL COMPANY (US) 1997-09-24 EP claimed
WO-1996017857-A1 IMPROVED PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES THE DOW CHEMICAL COMPANY (US) 1996-06-13 WO claimed
EP-1124834-B1 PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES DOW CHEMICAL CO (US) 2002-11-06 EP disclosed
EP-1124834-A1 PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES THE DOW CHEMICAL COMPANY (US) 2001-08-22 EP disclosed
US-6090962-A Preparation of titanium(II) or zirconium(II) complexes THE DOW CHEMICAL COMPANY (US) 2000-07-18 US disclosed
WO-2000026221-A1 PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES THE DOW CHEMICAL COMPANY (US) 2000-05-11 WO disclosed
EP-0796267-B1 IMPROVED PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES DOW CHEMICAL CO (US) 1998-12-02 EP disclosed
EP-0796267-A1 IMPROVED PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES THE DOW CHEMICAL COMPANY (US) 1997-09-24 EP disclosed
WO-1996017857-A1 IMPROVED PREPARATION OF TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES THE DOW CHEMICAL COMPANY (US) 1996-06-13 WO disclosed
US-5512693-A Preparation of titanium (II) or zirconium (II) complexes THE DOW CHEMICAL COMPANY (US) 1996-04-30 US disclosed