SCHEMBL16488385

SCHEMBL16488385

CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(/C=C/c4sc(/C=C(\C#N)C(=O)O)cc4CCCCCC)o3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 5/20 0.41
▸ PTGES O14684 1/20 0.41
▸ MAPT P10636 6/20 0.38
▸ THRB P10828 3/20 0.38
▸ SLC16A3 O15427 2/20 0.35
▸ SLC16A1 P53985 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RARB P10826 3/20 0.33

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
SCHEMBL16488359 0.77 TP53 (0.34) TP53MAPTTHRBLMNAHPGD
SCHEMBL29432831 0.76 PTGES (0.42) TP53PTGESMAPTSLC16A3SLC16A1
SCHEMBL16982633 0.76 MAPT (0.48) TP53PTGESMAPTSLC16A3SLC16A1
SCHEMBL16982621 0.76 MAPT (0.48) TP53PTGESMAPTSLC16A3SLC16A1
SCHEMBL31684370 0.74 PTGES (0.41) PTGESMAPTSLC16A3SLC16A1RARB
SCHEMBL22770748 0.74 PTGES (0.41) PTGESMAPTSLC16A3SLC16A1RARB
SCHEMBL14769757 0.74 MAPT (0.68) TP53PTGESMAPTSLC16A3SLC16A1
SCHEMBL31713031 0.73 MAPT (0.67) TP53PTGESMAPTSLC16A3SLC16A1
SCHEMBL29505886 0.73 MAPT (0.46) TP53PTGESMAPTSLC16A3SLC16A1
SCHEMBL29432836 0.72 PTGES (0.40) PTGESMAPTSLC16A3SLC16A1RARB

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
EP-2838128-B1 Dye-sensitized solar cells and methods of making same HONEYWELL ROMANIA S R L (RO) 2016-01-06 — — EP disclosed
EP-2838128-A1 Dye-sensitized solar cells and methods of making same Honeywell Romania S.R.L. (RO) 2015-02-18 — — EP disclosed
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