SCHEMBL7739598

SCHEMBL7739598

C[C]1CC[C@H]2[C@@H]3CCC4=C(O)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.77
TSHR P16473 1/20 0.77
THPO P40225 1/20 0.77
HIF1A Q16665 1/20 0.77
TDP1 Q9NUW8 1/20 0.77
CYP19A1 P11511 16/20 0.62
SHBG P04278 1/20 0.54

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
Formestane SCHEMBL25717 0.87 CYP3A4 (1.00) CYP3A4TSHRTHPOHIF1ATDP1
Formestane SCHEMBL13795108 0.87 CYP3A4 (1.00) CYP3A4TSHRTHPOHIF1ATDP1
Formestane SCHEMBL22891821 0.87 CYP3A4 (1.00) CYP3A4TSHRTHPOHIF1ATDP1
Formestane SCHEMBL14291425 0.87 CYP3A4 (1.00) CYP3A4TSHRTHPOHIF1ATDP1
Formestane SCHEMBL3230067 0.87 CYP3A4 (1.00) CYP3A4TSHRTHPOHIF1ATDP1
Formestane SCHEMBL947479 0.87 CYP3A4 (1.00) CYP3A4TSHRTHPOHIF1ATDP1
Formestane SCHEMBL13838287 0.87 CYP3A4 (1.00) CYP3A4TSHRTHPOHIF1ATDP1
SCHEMBL7156581 0.81 CYP3A4 (0.69) CYP3A4TSHRTHPOHIF1ATDP1
Oxymesterone SCHEMBL4317992 0.81 CYP3A4 (0.69) CYP3A4TSHRTHPOHIF1ATDP1
Oxymesterone SCHEMBL4317989 0.81 CYP3A4 (0.69) CYP3A4TSHRTHPOHIF1ATDP1

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-6410748-B1 Alicycli c group-containing monomer KABUSHIKI KAISHA TOSHIBA (JP) 2002-06-25 US disclosed
US-6291129-B1 LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-18 US disclosed