SCHEMBL12866302

SCHEMBL12866302

CCN(CC)c1ccc2c(c1)O/C(=C\c1ccc(O)c(O)c1)N2CCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.37
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
GAA P10253 4/20 0.34
TDP1 Q9NUW8 4/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAOA P21397 1/20 0.34

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
SCHEMBL12866303 0.83 EP300 (0.44) EP300S1PR1S1PR3GAATDP1
SCHEMBL12880708 0.79 MAOA (0.34) EP300GAATDP1MEN1KMT2A
SCHEMBL13005254 0.77 MEN1 (0.39) GAATDP1MEN1KMT2AMAOA
SCHEMBL12866244 0.75 MAOB (0.42) GAAMEN1KMT2AMAOAMAOB
SCHEMBL12880702 0.74 MAOB (0.39) GAAMEN1KMT2AMAOAMAOB
SCHEMBL13016923 0.65 KDM4E (0.33) GAAMEN1KMT2AMAOAMAOB
SCHEMBL16507831 0.62 MEN1 (0.41) GAATDP1MEN1KMT2APOLB
SCHEMBL25434589 0.62 NOX4 (0.71) GAATDP1MEN1KMT2AMAPT
SCHEMBL25434593 0.62 NOX4 (0.71) GAATDP1MEN1KMT2AMAPT
SCHEMBL7007991 0.61 P2RX4 (0.56) TDP1MEN1KMT2AMAOBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 US disclosed
US-8338700-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 US disclosed
US-20110030801-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 US disclosed
US-20110031446-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 US disclosed
US-7851701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-12-14 US disclosed