SCHEMBL10046554

SCHEMBL10046554

Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C(/C#N)C(=O)O)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 1/20 0.59
KDM4E B2RXH2 1/20 0.59
SLC16A3 O15427 1/20 0.59
ALDH1A1 P00352 1/20 0.59
CYP3A4 P08684 1/20 0.59
HPGD P15428 1/20 0.59
SLC16A1 P53985 1/20 0.59
GPR35 Q9HC97 1/20 0.59
EGFR P00533 1/20 0.59

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
SCHEMBL10058489 1.00 CISD1 (0.59) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL10058492 1.00 CISD1 (0.59) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL12661978 1.00 CISD1 (0.59) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL11941572 1.00 CISD1 (0.59) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL15129030 1.00 CISD1 (0.59) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL10046555 0.96 CISD1 (0.55) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL28335410 0.96 SLC16A3 (0.57) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL10059146 0.96 CISD1 (0.55) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL12673135 0.96 SLC16A3 (0.57) CISD1KDM4ESLC16A3ALDH1A1CYP3A4
SCHEMBL7006727 0.96 CISD1 (0.55) CISD1KDM4ESLC16A3ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120073661-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2012-03-29 US disclosed