SCHEMBL14733307

SCHEMBL14733307

CCc1ccc(C2CCC(c3ccc(Oc4ccc(C)cc4)cc3)(c3ccc(Oc4ccc(N)cc4)cc3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD4 Q15561 1/20 0.44
ALDH1A1 P00352 5/20 0.43
MAPT P10636 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 1/20 0.43
CYP19A1 P11511 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
TSHR P16473 2/20 0.33
CYP3A4 P08684 1/20 0.33
FFAR4 Q5NUL3 1/20 0.32
MAPK1 P28482 1/20 0.32
MMP13 P45452 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL9073407 0.95 CYP19A1 (0.39) TEAD4ALDH1A1MAPTTDP1POLB
SCHEMBL9280585 0.92 TEAD4 (0.53) TEAD4ALDH1A1MAPTTDP1POLB
SCHEMBL9073855 0.86 SPHK1 (0.39) TEAD4ALDH1A1MAPTTDP1CYP19A1
SCHEMBL9074335 0.84 SLC6A2 (0.35) ALDH1A1CYP19A1SMN1; SMN2NPC1RAB9A
SCHEMBL9074332 0.84 SLC6A4 (0.35) CYP19A1SMN1; SMN2NPC1RAB9ASLC6A2
SCHEMBL29713431 0.84 ALDH1A1 (0.40) ALDH1A1MAPTCYP19A1SMN1; SMN2L3MBTL1
SCHEMBL9074631 0.84 SPHK1 (0.45) CYP19A1
SCHEMBL9074859 0.83 SPHK1 (0.50) CYP19A1
SCHEMBL9073799 0.82 SPHK1 (0.52) CYP19A1
SCHEMBL9075410 0.82 SPHK1 (0.52) CYP19A1

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-20130053513-A1 LIQUID CRYSTAL ALIGNMENT AGENT, AND LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT FORMED FROM THE LIQUID CRYSTAL ALIGNMENT AGENT CHI MEI CORPORATION (TW) 2013-02-28 US disclosed