SCHEMBL16335010

SCHEMBL16335010

CCCCC(CC)CN1C(=O)c2sc3c(Br)sc(Br)c3c2C1=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
THRB P10828 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL1037798 0.83 ALDH1A1 (0.41) KDM4EALDH1A1THRBHPGDKMT2A
SCHEMBL16335314 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL1498216 0.80 ALDH1A1 (0.39) KDM4EALDH1A1THRBHPGDKMT2A
SCHEMBL16334216 0.79 PTGS1 (0.37) ALDH1A1HPGD
SCHEMBL19721700 0.78 KDM4E (0.37) KDM4EALDH1A1THRBHPGDKMT2A
SCHEMBL17146461 0.78 KDM4E (0.37) KDM4EALDH1A1THRBHPGDKMT2A
SCHEMBL12075727 0.76 ALDH1A1 (0.39) KDM4EALDH1A1THRBHPGDKMT2A
SCHEMBL1498233 0.74 KMT2A (0.39) KDM4EALDH1A1THRBHPGDKMT2A
SCHEMBL12700061 0.74 KDM4E (0.33) KDM4EALDH1A1THRBHPGDKMT2A
SCHEMBL12361099 0.74 ALDH1A1 (0.40) KDM4EALDH1A1THRBHPGDKMT2A

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-9818945-B2 Polymer and solar cell using the same KABUSHIKI KAISHA TOSHIBA (JP) 2017-11-14 US disclosed
US-20160099414-A1 POLYMER AND SOLAR CELL USING THE SAME KABUSHIKI KAISHA TOSHIBA (JP) 2016-04-07 US disclosed
WO-2014208011-A1 POLYMER AND SOLAR CELL USING THE SAME KABUSHIKI KAISHA TOSHIBA (JP) 2014-12-31 WO disclosed