SCHEMBL7167017

SCHEMBL7167017

CCC1CC(CC)(CC)CC(c2ccc(O)cc2)(c2ccc(O)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.46
ESR2 Q92731 3/20 0.46

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
SCHEMBL1323965 0.85 ESR1 (0.47) ESR1ESR2
SCHEMBL3691121 0.83 ESR1 (0.64) ESR1ESR2
SCHEMBL4309979 0.80 ESR1 (0.31) ESR1ESR2
SCHEMBL9074542 0.74 ESR2 (0.53) ESR1ESR2
SCHEMBL9075236 0.73 ESR2 (0.51) ESR1ESR2
SCHEMBL7183973 0.73 ESR2 (0.55) ESR1ESR2
SCHEMBL6453699 0.71 ESR1 (0.45) ESR1ESR2
SCHEMBL9772743 0.71 ESR1 (0.52) ESR1ESR2
SCHEMBL3302930 0.69 ESR2 (0.69) ESR1ESR2
SCHEMBL6450658 0.69 ESR1 (0.42) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6565967-B1 For water-repellent surfaces BAYER AKTIENGESELLSCHAFT (DE) 2003-05-20 US disclosed