SCHEMBL16656147

SCHEMBL16656147

CC(C)(C)CC(C)(C)c1ccc(O)c(Cc2cc(C(C)(C)CC(C)(C)C)cc(Cc3cc(C(C)(C)CC(C)(C)C)ccc3O)c2O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.66
ESR1 P03372 4/20 0.66
SMN1; SMN2 Q16637 4/20 0.66
USP2 O75604 3/20 0.66
MEN1 O00255 2/20 0.66
MAPT P10636 2/20 0.66
CASP1 P29466 2/20 0.66
KMT2A Q03164 2/20 0.66
TP53 P04637 1/20 0.66
PGR P06401 1/20 0.66
ADORA3 P0DMS8 1/20 0.66
AR P10275 1/20 0.66
DRD1 P21728 1/20 0.66
PTGS1 P23219 1/20 0.66
SLC6A2 P23975 1/20 0.66
PDE4A P27815 1/20 0.66
MAPK1 P28482 1/20 0.66
SLC6A4 P31645 1/20 0.66
OPRM1 P35372 1/20 0.66
DRD3 P35462 1/20 0.66

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
SCHEMBL27365471 0.94 CYP3A4 (0.60) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL71922 0.93 CYP3A4 (0.73) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL27365508 0.92 CYP3A4 (0.61) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL1345526 0.85 ESR1 (0.50) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL1345213 0.85 ESR1 (0.50) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL1346231 0.85 ESR1 (0.50) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL1345198 0.85 ESR1 (0.50) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL27365440 0.84 CYP3A4 (0.50) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL27365540 0.84 ESR1 (0.56) CYP3A4ESR1SMN1; SMN2USP2MEN1
SCHEMBL10464426 0.84 CYP3A4 (0.50) CYP3A4ESR1SMN1; SMN2USP2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023116663-A1 METHOD FOR SYNTHESIZING TYLOXAPOL 沈阳兴齐眼药股份有限公司 2023-06-29 WO disclosed
US-20150183977-A1 OPTICAL FILM AND METHOD FOR MANUFACTURING SAME, POLARIZATION PLATE, AND LIQUID CRYSTAL DISPLAY APPARATUS FUJIFILM CORPORATION (JP) 2015-07-02 US disclosed
US-9013656-B2 Polarizing plate and liquid crystal display FUJIFILM CORPORATION (JP) 2015-04-21 US disclosed