SCHEMBL4309979

SCHEMBL4309979

CCC1CC(CC)(CC)CC(c2ccc(O)c(Br)c2)(c2ccc(O)c(Br)c2)C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL7167017 0.80 ESR1 (0.46) ESR1ESR2
SCHEMBL4316667 0.77 CRHBP (0.33)
SCHEMBL30295754 0.70 ESR1 (0.63) ESR1ESR2ALOX15
SCHEMBL296382 0.70 ESR1 (0.63) ESR1ESR2ALOX15
SCHEMBL1323965 0.65 ESR1 (0.47) ESR1ESR2ALOX15
SCHEMBL4425531 0.64 ESR1 (0.55) ESR1ESR2
SCHEMBL3691121 0.64 ESR1 (0.64) ESR1ESR2
SCHEMBL297456 0.64 ESR1 (0.62) ESR1ESR2ALOX15
SCHEMBL20790078 0.64 MEN1 (0.59) ALOX15
SCHEMBL29822116 0.64 ESR1 (0.62) ESR1ESR2ALOX15

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-7501481-B2 Process for production of copolycarbonates with reduced color SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2009-03-10 US disclosed
US-20080076902-A1 Process for Production of Copolycarbonates with Reduced Color SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2008-03-27 US disclosed