SCHEMBL16080128

SCHEMBL16080128

CO[Si](OC)(OC)c1ccc(NC(=O)c2ccc(-c3c4nc(c(-c5ccccc5)c5ccc([nH]5)c(-c5ccccc5)c5nc(c(-c6ccccc6)c6ccc3[nH]6)C=C5)C=C4)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 3/20 0.52
▸ CYCS P99999 4/20 0.51
▸ ABCG2 Q9UNQ0 1/20 0.47
▸ PTPN1 P18031 2/20 0.46
▸ HPSE Q9Y251 1/20 0.44
▸ MMP2 P08253 2/20 0.43
▸ MMP9 P14780 2/20 0.43
▸ MMP8 P22894 2/20 0.43
▸ MMP13 P45452 2/20 0.43
▸ DEGS1 O15121 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ STAT3 P40763 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL7252275 0.81 TOP1 (0.55) TOP1CYCSPTPN1MMP2MMP9
SCHEMBL25046485 0.79 TOP1 (0.66) TOP1CYCSABCG2SMN1; SMN2
SCHEMBL30925006 0.79 TOP1 (0.66) TOP1CYCSABCG2SMN1; SMN2
SCHEMBL15131997 0.79 TOP1 (0.66) TOP1CYCSABCG2STAT3SMN1; SMN2
SCHEMBL3788647 0.79 TOP1 (0.66) TOP1CYCSABCG2SMN1; SMN2
SCHEMBL29684671 0.78 TOP1 (0.64) TOP1CYCSABCG2SMN1; SMN2
SCHEMBL6688602 0.78 TOP1 (0.64) TOP1CYCSABCG2SMN1; SMN2
SCHEMBL13967043 0.76 TOP1 (0.73) TOP1CYCSABCG2STAT3SMN1; SMN2
SCHEMBL2403632 0.76 TOP1 (0.54) TOP1CYCSABCG2STAT3
SCHEMBL16923748 0.76 ALDH1A1 (0.55) TOP1CYCSABCG2

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-9805879-B2 Dye-sensitized solar cell ADEKA CORPORATION (JP) 2017-10-31 — — US disclosed
US-9530571-B2 Compound and support material supporting this novel compound ADEKA CORPORATION (JP) 2016-12-27 — — US disclosed
US-20140299191-A1 DYE-SENSITIZED SOLAR CELL ADEKA CORPORATION (JP) 2014-10-09 — — US disclosed
US-20140261647-A1 NOVEL COMPOUND AND SUPPORT MATERIAL SUPPORTING THIS NOVEL COMPOUND ADEKA CORPORATION (JP) 2014-09-18 — — US disclosed
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