SCHEMBL11268864

SCHEMBL11268864

C(=Cc1ccc2cc(C=Cc3ccccc3)ccc2c1)c1ccccc1

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.91
PLG P00747 1/20 0.63
PLAU P00749 1/20 0.63
PLAT P00750 1/20 0.63
KLK1 P06870 1/20 0.63
ALDH1A1 P00352 1/20 0.59
GLA P06280 1/20 0.59
MAPT P10636 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
PTGS1 P23219 1/20 0.57
NFE2L2 Q16236 2/20 0.54
CYP19A1 P11511 2/20 0.54
MAOA P21397 2/20 0.54
MAOB P27338 2/20 0.54
TRPA1 O75762 1/20 0.54
NQO2 P16083 2/20 0.53
CYP1A1 P04798 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP1B1 Q16678 1/20 0.52
PDGFRB P09619 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
SCHEMBL11209385 1.00 RELA (0.91) RELAPLGPLAUPLATKLK1
SCHEMBL5407847 0.95 RELA (1.00) RELAPLGPLAUPLATKLK1
SCHEMBL5548865 0.95 RELA (0.83) RELAPLGPLAUPLATKLK1
SCHEMBL5407848 0.95 RELA (1.00) RELAPLGPLAUPLATKLK1
SCHEMBL30507765 0.95 RELA (1.00) RELAPLGPLAUPLATKLK1
SCHEMBL5548861 0.95 RELA (0.83) RELAPLGPLAUPLATKLK1
SCHEMBL3984479 0.95 RELA (1.00) RELAPLGPLAUPLATKLK1
SCHEMBL5406013 0.93 RELA (0.87) RELAPLGPLAUPLATKLK1
SCHEMBL5406009 0.93 RELA (0.87) RELAPLGPLAUPLATKLK1
SCHEMBL5406016 0.93 RELA (0.87) RELAPLGPLAUPLATKLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4335055-A Process for the preparation of alkenylbenzene derivatives or alkenylnaphthalene derivatives CIBA-GEIGY CORPORATION (US) 1982-06-15 US disclosed
US-4250053-A WITH FLUORESCENT COMPOUND MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1981-02-10 US disclosed
US-4158099-A FROM SCHIFF BASES AND BIPHENYL COMPOUND CIBA-GEIGY AG (CH) 1979-06-12 US disclosed
US-3991049-A Aromatic compounds containing ethylene double bonds, processes for their manufacture and use CIBA-GEIGY AG (CH) 1976-11-09 US disclosed