SCHEMBL9359263

SCHEMBL9359263

CC(C)(C)CC(C)(C)c1ccc2c(c1)Sc1cc(C(C)(C)CC(C)(C)C)ccc1OP(F)O2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.39
CYP3A4 P08684 3/20 0.35
CYP2D6 P10635 1/20 0.35
HIF1A Q16665 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
ESR1 P03372 1/20 0.32
TP53 P04637 1/20 0.32
PGR P06401 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
AR P10275 1/20 0.32
MAPT P10636 1/20 0.32
DRD1 P21728 1/20 0.32
PTGS1 P23219 1/20 0.32
SLC6A2 P23975 1/20 0.32
PDE4A P27815 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP1 P29466 1/20 0.32
SLC6A4 P31645 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
SCHEMBL7639662 0.86 NPC1 (0.36) SMN1; SMN2MEN1MAPTMAPK1KMT2A
SCHEMBL7637526 0.80 CNR2 (0.42)
SCHEMBL9515201 0.79 SHBG (0.37) SHBGCYP3A4CYP2D6HIF1ASMN1; SMN2
SCHEMBL11216918 0.79 CYP3A4 (0.35) SHBGCYP3A4CYP2D6HIF1ASMN1; SMN2
SCHEMBL8987626 0.75 SHBG (0.39) SHBGCYP3A4CYP2D6HIF1ASMN1; SMN2
SCHEMBL10415168 0.75 SHBG (0.31) SHBG
SCHEMBL2456413 0.71 SNCA (0.43) SHBGCYP3A4CYP2D6HIF1ASMN1; SMN2
SCHEMBL29504844 0.71 SNCA (0.43) SHBGCYP3A4CYP2D6HIF1ASMN1; SMN2
SCHEMBL32664685 0.70 SHBG (0.31) SHBG
SCHEMBL10583715 0.68 SHBG (0.34) SHBGCYP3A4CYP2D6HIF1ASMN1; SMN2

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
EP-0416321-B1 Crystalline polyolefin composition CHISSO CORP (JP) 1994-11-09 EP disclosed
US-5063264-A Molding materials CHISSO CORPORATION (JP) 1991-11-05 US disclosed
EP-0416321-A1 Crystalline polyolefin composition Chisso Corporation (JP) 1991-03-13 EP disclosed