SCHEMBL8945087

SCHEMBL8945087

CCCC1(Cc2ccc(N)cc2)CCCCC1c1ccccc1CC

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 2/20 0.35
HTR6 P50406 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HDAC4 P56524 1/20 0.32
GSK3B P49841 1/20 0.31
EPHX1 P07099 1/20 0.30
CYP19A1 P11511 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
SCHEMBL8945429 0.92 SLC10A2 (0.32) SLC10A2HTR6
SCHEMBL8945125 0.91 GSK3B (0.34) SLC10A2HTR6KDM4EMEN1MAPT
SCHEMBL8945071 0.87 SLC10A2 (0.33) SLC10A2HTR6
SCHEMBL8945308 0.86 KDM1A (0.40) SLC10A2HTR6KDM4E
SCHEMBL8945269 0.84 HTR6 (0.32) HTR6GSK3B
SCHEMBL8945039 0.81 SLC10A2 (0.35) SLC10A2HTR6GSK3BCYP19A1
SCHEMBL8945145 0.80 SLC10A2 (0.33) SLC10A2HTR6GSK3BCYP19A1
SCHEMBL8945347 0.79 CYP19A1 (0.33) SLC10A2HTR6CYP19A1
SCHEMBL8945330 0.79 CYP19A1 (0.33) SLC10A2HTR6CYP19A1
SCHEMBL8945247 0.79 CYP19A1 (0.33) SLC10A2HTR6CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5501884-A Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1996-03-26 US disclosed