SCHEMBL10109653

SCHEMBL10109653

Cc1ccc(C2CCC3Oc4ccccc4C3C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
MAOB P27338 2/20 0.37
CYP19A1 P11511 1/20 0.34
PRCP P42785 1/20 0.33
HTR6 P50406 1/20 0.32
SLC6A2 P23975 4/20 0.32
SLC6A4 P31645 4/20 0.32
SLC6A3 Q01959 4/20 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
SCHEMBL10109666 0.79 ESR1 (0.37) ESR1ESR2
SCHEMBL10109661 0.75 ESR1 (0.37) ESR1ESR2
SCHEMBL26227708 0.74 ESR1 (0.42) ESR1ESR2MAOBHTR6
SCHEMBL17974163 0.72 ESR1 (0.40) ESR1ESR2MAOBHTR6SLC6A2
SCHEMBL18752234 0.71 ESR1 (0.34) ESR1ESR2
SCHEMBL14514612 0.70 ESR2 (0.74) ESR1ESR2MAOB
SCHEMBL14514608 0.70 ESR2 (0.74) ESR1ESR2MAOB
SCHEMBL8029622 0.68 SLC18A3 (0.38) LMNAESR2
SCHEMBL7317272 0.68 ESR1 (0.47) ESR1ESR2
SCHEMBL10682685 0.68 ESR1 (0.51) ESR1ESR2

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-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed
US-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed