SCHEMBL13345142

SCHEMBL13345142

CCC1CCC2C3CCc4cc(O)ccc4C3CC[C@]12C

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.72
LMNA P02545 6/20 0.72
ESR2 Q92731 5/20 0.72
KMT2A Q03164 5/20 0.72
MEN1 O00255 4/20 0.72
CYP3A4 P08684 4/20 0.72
MAPT P10636 4/20 0.72
HSD17B10 Q99714 3/20 0.72
PGR P06401 3/20 0.72
AR P10275 3/20 0.72
STS P08842 3/20 0.72
TSHR P16473 2/20 0.72
CYP2C9 P11712 2/20 0.72
CYP2C19 P33261 2/20 0.72
HIF1A Q16665 2/20 0.72
NR3C1 P04150 2/20 0.72
SHBG P04278 2/20 0.72
SERPINA6 P08185 2/20 0.72
SLC6A4 P31645 2/20 0.72
SNCA P37840 2/20 0.72

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
SCHEMBL14395341 1.00 ESR1 (0.72) ESR1LMNAESR2KMT2AMEN1
SCHEMBL5158676 1.00 ESR1 (0.72) ESR1LMNAESR2KMT2AMEN1
SCHEMBL11776204 0.94 ESR1 (0.65) ESR1LMNAESR2KMT2AMEN1
SCHEMBL5157957 0.91 ESR1 (0.69) ESR1LMNAESR2KMT2AMEN1
SCHEMBL5158101 0.89 ESR1 (0.70) ESR1LMNAESR2KMT2AMEN1
SCHEMBL11783196 0.88 STS (0.69) ESR1LMNAESR2KMT2AMEN1
SCHEMBL15307735 0.87 ESR1 (0.56) ESR1LMNAESR2KMT2AMEN1
SCHEMBL11780732 0.87 STS (0.67) ESR1LMNAESR2KMT2AMEN1
SCHEMBL17817385 0.87 STS (0.67) ESR1LMNAESR2KMT2AMEN1
SCHEMBL11788270 0.87 STS (0.67) ESR1LMNAESR2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2202240-A1 Compound Sterix Limited (GB) 2010-06-30 EP disclosed