SCHEMBL16265129

SCHEMBL16265129

BB(B)B(B(B)B)B(B(B(B)B)B(B)B)C1CCC(c2ccc(-c3ccc(Oc4cc(N)ccc4N)cc3)cc2)CC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32

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
SCHEMBL16265148 0.84 KDM4E (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL16265122 0.84 SCN5A (0.34)
SCHEMBL17722783 0.82 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL12220499 0.80 ESR2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL12241897 0.79 SLC6A4 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL16265121 0.77 SCN5A (0.34)
SCHEMBL16265109 0.74 NPC1 (0.32)
SCHEMBL12220497 0.72 ESR2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL16577057 0.72 NPC1 (0.30)
SCHEMBL12241901 0.72 SLC6A4 (0.39) SLC6A2SLC6A4SLC6A3

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-20150274969-A1 LIQUID CRYSTAL ALIGNMENT AGENT AND USES THEREOF CHI MEI CORPORATION (TW) 2015-10-01 US disclosed
US-20140350179-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT HAVING THEREOF CHI MEI CORPORATION (TW) 2014-11-27 US disclosed