SCHEMBL863291

SCHEMBL863291

Cc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\C#N)OC=O)cc3)cc2)c2ccc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.41
SLC16A3 O15427 2/20 0.39
SLC16A1 P53985 2/20 0.39
CISD1 Q9NZ45 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
GPR35 Q9HC97 1/20 0.39

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
SCHEMBL10046556 0.90 CISD1 (0.47) EGFRSLC16A3SLC16A1CISD1KDM4E
SCHEMBL440104 0.89 EGFR (0.47) EGFRSLC16A3SLC16A1CISD1KDM4E
SCHEMBL11988634 0.86 CISD1 (0.45) EGFRSLC16A3SLC16A1CISD1KDM4E
SCHEMBL437075 0.86 EGFR (0.50) EGFRSLC16A3SLC16A1CISD1KDM4E
SCHEMBL11988507 0.83 EGFR (0.43) EGFRSLC16A3SLC16A1CISD1KDM4E
SCHEMBL11988566 0.81 CISD1 (0.44) EGFRSLC16A3SLC16A1CISD1KDM4E
SCHEMBL14769780 0.80 SLC16A3 (0.46) EGFRSLC16A3SLC16A1CISD1KDM4E
SCHEMBL12669273 0.79 ALDH1A1 (0.48) EGFRSLC16A3SLC16A1CISD1KDM4E
SCHEMBL14960903 0.79 MAPT (0.58) SLC16A3SLC16A1ALDH1A1HPGD
SCHEMBL863297 0.79 ALDH1A1 (0.45) EGFRSLC16A3SLC16A1CISD1KDM4E

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
US-20120325319-A1 PHOTOELECTRIC CONVERSION ELEMENT, METHOD FOR PRODUCING PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2012-12-27 US disclosed
US-20120247562-A1 DYE-SENSITIZED SOLAR CELL AND METHOD OF MANUFACTURING THE SAME KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2012-10-04 US disclosed
US-20120073661-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2012-03-29 US disclosed