SCHEMBL12534616

SCHEMBL12534616

C=C/C=C(C#N)/C=C/C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL14214223 1.00
SCHEMBL25996175 0.79
SCHEMBL24894688 0.78
SCHEMBL14294038 0.78
SCHEMBL13980120 0.78
SCHEMBL8313618 0.76
SCHEMBL22785958 0.76 ALDH1A1 (0.32)
SCHEMBL13770581 0.76
SCHEMBL14616046 0.76
SCHEMBL12534612 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9424999-B2 Dye for photoelectric conversion device and photoelectric conversion device ADEKA CORPORATION (JP) 2016-08-23 US disclosed
US-9424999-B2 Dye for photoelectric conversion device and photoelectric conversion device ADEKA CORPORATION (JP) 2016-08-23 US disclosed
US-20150027542-A1 DYE FOR PHOTOELECTRIC CONVERSION DEVICE AND PHOTOELECTRIC CONVERSION DEVICE ADEKA CORPORATION (JP) 2015-01-29 US disclosed
US-20150027542-A1 DYE FOR PHOTOELECTRIC CONVERSION DEVICE AND PHOTOELECTRIC CONVERSION DEVICE ADEKA CORPORATION (JP) 2015-01-29 US disclosed
US-8884029-B2 Dye for photoelectric conversion device and photoelectric conversion device ADEKA CORPORATION (JP) 2014-11-11 US disclosed
US-8884029-B2 Dye for photoelectric conversion device and photoelectric conversion device ADEKA CORPORATION (JP) 2014-11-11 US disclosed
US-20110155249-A1 DYE FOR PHOTOELECTRIC CONVERSION DEVICE AND PHOTOELECTRIC CONVERSION DEVICE TDK CORPORATION (JP) 2011-06-30 US disclosed
US-20110155249-A1 DYE FOR PHOTOELECTRIC CONVERSION DEVICE AND PHOTOELECTRIC CONVERSION DEVICE TDK CORPORATION (JP) 2011-06-30 US disclosed
EP-2330680-A1 DYE FOR PHOTOELECTRIC CONVERSION ELEMENT AND PHOTOELECTRIC CONVERSION ELEMENT TDK Corporation (JP) 2011-06-08 EP disclosed