SCHEMBL9314092

SCHEMBL9314092

CC1(C)CCC(C)(C)C2CC(=O)CCC21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.38
AKR1B10 O60218 3/20 0.38
AKR1B1 P15121 3/20 0.38
OR51E2 Q9H255 1/20 0.38
SHBG P04278 6/20 0.36
SRD5A2 P31213 2/20 0.36
GPBAR1 Q8TDU6 2/20 0.34
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
SERPINA6 P08185 1/20 0.34
NR3C2 P08235 1/20 0.34
CYP3A4 P08684 1/20 0.34
AR P10275 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MGAM O43451 1/20 0.34
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL14882252 0.84 MEN1 (0.33) MAPK1MAPTMEN1ALDH1A1LMNA
SCHEMBL16010889 0.84 MEN1 (0.33) MAPK1MAPTMEN1ALDH1A1LMNA
SCHEMBL18741025 0.79 SHBG (0.38) CYP19A1AKR1B10AKR1B1OR51E2SHBG
SCHEMBL18740940 0.79 SHBG (0.41) CYP19A1AKR1B10AKR1B1OR51E2SHBG
SCHEMBL6276753 0.77 SHBG (0.38) CYP19A1AKR1B10AKR1B1OR51E2SHBG
SCHEMBL17988645 0.77 SHBG (0.38) CYP19A1AKR1B10AKR1B1OR51E2SHBG
SCHEMBL22443364 0.76 SHBG (0.39) CYP19A1AKR1B10AKR1B1OR51E2SHBG
SCHEMBL22443225 0.76 SHBG (0.39) CYP19A1AKR1B10AKR1B1OR51E2SHBG
SCHEMBL22443205 0.76 SHBG (0.36) CYP19A1AKR1B10AKR1B1OR51E2SHBG
SCHEMBL9767861 0.76 SHBG (0.39) CYP19A1AKR1B10AKR1B1OR51E2SHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0480237-B1 Particular dihydroxydiphenylbicycloalkanes, their preparation and their use for the preparation of high molecular polycarbonates BAYER AG (DE) 1994-11-30 EP disclosed
US-5276213-A Special dihydroxydiphenyl bicycloalkanes, their production and their use for the production of high molecular weight polycarbonates BAYER AKTIENGESELLSCHAFT (DE) 1994-01-04 US disclosed
US-5212280-A POLYCARBONATE FROM SPECIAL DIHYDROXYDIPHENYL BICYCLOALKANE BAYER AKTIENGESELLSCHAFT (DE) 1993-05-18 US disclosed
EP-0480237-A1 Particular dihydroxydiphenylbicycloalkanes, their preparation and their use for the preparation of high molecular polycarbonates BAYER AG (DE) 1992-04-15 EP disclosed