SCHEMBL13712969

SCHEMBL13712969

CC(C)(c1ccc(O)cc1)c1ccc(C(C)(C)c2ccc(OC=O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.59
ESR2 Q92731 8/20 0.59
CYP3A4 P08684 3/20 0.59
AR P10275 1/20 0.59
HPGD P15428 1/20 0.59
TSHR P16473 1/20 0.59
SLC6A2 P23975 1/20 0.59
SLC6A4 P31645 1/20 0.59
HTR6 P50406 1/20 0.59
ESRRG P62508 1/20 0.59
SLC6A3 Q01959 1/20 0.59
HSD17B10 Q99714 1/20 0.59
ALDH1A1 P00352 3/20 0.52
LMNA P02545 1/20 0.43
TYR P14679 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 2/20 0.41
ELANE P08246 2/20 0.39
SHBG P04278 1/20 0.37

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
SCHEMBL304805 1.00 ESR1 (0.59) ESR1ESR2CYP3A4ARHPGD
SCHEMBL15417635 0.95 ESR2 (0.53) ESR1ESR2CYP3A4ARHPGD
SCHEMBL13712957 0.91 ESR1 (0.67) ESR1ESR2CYP3A4ARHPGD
SCHEMBL7590568 0.90 HPGD (0.41) ESR1ESR2CYP3A4ARHPGD
SCHEMBL21538673 0.87 ESR1 (0.42) ESR1ESR2CYP3A4ARHPGD
SCHEMBL308378 0.84 MEN1 (0.50) ESR1ESR2CYP3A4HPGDHSD17B10
SCHEMBL13447587 0.83 SMN1; SMN2 (0.49) ESR1ESR2CYP3A4ALDH1A1LMNA
SCHEMBL12329883 0.83 ALDH1A1 (0.45) HSD17B10ALDH1A1LMNAMEN1KMT2A
SCHEMBL12325325 0.83 TSHR (0.41) ESR1ESR2CYP3A4ARHPGD
SCHEMBL9887145 0.83 ESR1 (0.65) ESR1ESR2CYP3A4ARHPGD

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
US-7582355-B2 Optical unit using plastic lenses FUJIFILM CORPORATION (JP) 2009-09-01 US disclosed