SCHEMBL8358274

SCHEMBL8358274

CC(C)(C)CC(C)(C)c1ccc2ccc(O)c(C(=O)O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.45
CYP2D6 P10635 1/20 0.45
HIF1A Q16665 1/20 0.45
SHBG P04278 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ESR1 P03372 1/20 0.41
TP53 P04637 1/20 0.41
PGR P06401 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
AR P10275 1/20 0.41
MAPT P10636 1/20 0.41
DRD1 P21728 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
PDE4A P27815 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
SLC6A4 P31645 1/20 0.41

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
SCHEMBL8356326 0.90 CYP3A4 (0.44) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL8360792 0.83 ALDH1A1 (0.48) CYP2D6SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL8358275 0.81 CNR1 (0.47)
SCHEMBL8362063 0.81 SHBG (0.38) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL11555238 0.80 LDHA (0.47) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL1110466 0.77 CYP3A4 (0.50) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL29987613 0.77 CYP3A4 (0.50) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL7773033 0.76 CYP3A4 (0.49) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL7773029 0.76 CYP3A4 (0.49) CYP3A4CYP2D6HIF1ASHBGSMN1; SMN2
SCHEMBL6354382 0.74 SHBG (0.44) CYP3A4CYP2D6HIF1ASHBGSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5990332-A EXCELLENT IN CHARGE CONTROL OR CHARGE-ENHANCING PROPERTY, AND TONER FOR DEVELOPING ELECTROSTATIC IMAGES AND POWDERY PAINT FOR ELECTROSTATIC PAINTING ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-23 US disclosed
US-5976749-A TONER FOR DEVELOPING ELECTROSTATIC IMAGES ORIENT CHEMICAL INDUSTRIES, LTD (JP) 1999-11-02 US disclosed