SCHEMBL20044969

SCHEMBL20044969

CCCC/C=C/c1ccc2cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c4cc5cc(/C=C/CCCC)ccc5cc4c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc2c1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
CTNNB1 P35222 1/20 0.30
TCF7L2 Q9NQB0 1/20 0.30
LTB4R Q15722 1/20 0.30

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
SCHEMBL20044996 0.97 HDAC1 (0.38) HDAC1HDAC8
SCHEMBL20044974 0.75 S1PR1 (0.37)
SCHEMBL19716202 0.74 RAB9A (0.41)
SCHEMBL20044988 0.74 NPC1 (0.43) HDAC1
SCHEMBL19716218 0.73 SLC22A12 (0.41) HDAC1HDAC8
SCHEMBL20044963 0.72 SIGMAR1 (0.37) HDAC1HDAC8
SCHEMBL5989852 0.71 CYP1A1 (0.36)
SCHEMBL16807606 0.71 HDAC1 (0.37) HDAC1HDAC8
SCHEMBL20044956 0.71 CACNA2D1 (0.35)
SCHEMBL29084182 0.71 HDAC1 (0.56) HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed