SCHEMBL9166699

SCHEMBL9166699

C(=Cc1ccc2ccc(C=Cc3ccccc3)cc2c1)c1ccccc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.86
ALDH1A1 P00352 1/20 0.57
GLA P06280 1/20 0.57
MAPT P10636 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
PLG P00747 1/20 0.56
PLAU P00749 1/20 0.56
PLAT P00750 1/20 0.56
KLK1 P06870 1/20 0.56
PTGS1 P23219 1/20 0.55
MAOB P27338 3/20 0.52
NFE2L2 Q16236 2/20 0.52
CYP19A1 P11511 2/20 0.52
MAOA P21397 2/20 0.52
NQO2 P16083 2/20 0.52
CYP1A1 P04798 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP1B1 Q16678 1/20 0.50
PDGFRB P09619 1/20 0.48
PDGFRA P16234 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
SCHEMBL9166695 1.00 RELA (0.86) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL5548861 0.93 RELA (0.83) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL5548865 0.93 RELA (0.83) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL3984479 0.93 RELA (1.00) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL5407848 0.93 RELA (1.00) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL5407847 0.93 RELA (1.00) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL30507765 0.93 RELA (1.00) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL11209385 0.92 RELA (0.91) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL11268864 0.92 RELA (0.91) RELAALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL5406013 0.91 RELA (0.87) RELAALDH1A1GLAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109485446-B Carbon/carbon composite material and preparation method thereof 湖南众德新材料科技有限公司 2021-11-09 CN claimed
CN-109485446-B Carbon/carbon composite material and preparation method thereof 湖南众德新材料科技有限公司 2021-11-09 CN disclosed
US-5403520-A Nonlinear optical device and optical signal processing unit UBE INDUSTRIES, LTD. (JP) 1995-04-04 US disclosed