SCHEMBL3179897

SCHEMBL3179897

Oc1ccc(C(CCCCC(c2ccc(O)cc2)(c2ccc(O)cc2)c2ccc(O)cc2)(c2ccc(O)cc2)c2ccc(O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 9/20 0.50
▸ ESR2 Q92731 8/20 0.50
▸ CYP3A4 P08684 3/20 0.46
▸ LMNA P02545 2/20 0.46
▸ TYR P14679 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ AR P10275 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ SLC6A2 P23975 1/20 0.46
▸ SLC6A4 P31645 1/20 0.46
▸ HTR6 P50406 1/20 0.46
▸ ESRRG P62508 1/20 0.46
▸ SLC6A3 Q01959 1/20 0.46
▸ KIF11 P52732 6/20 0.46
▸ SHBG P04278 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ NPC1 O15118 1/20 0.42

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
SCHEMBL8731649 0.95 ESR1 (0.50) ESR1ESR2CYP3A4LMNATYR
SCHEMBL8408018 0.89 ESR1 (0.52) ESR1ESR2CYP3A4LMNATYR
SCHEMBL6743316 0.89 ESR1 (0.62) ESR1ESR2CYP3A4LMNAHSD17B10
SCHEMBL1691543 0.87 ESR1 (0.60) ESR1ESR2CYP3A4LMNAHSD17B10
SCHEMBL6743890 0.87 ESR1 (0.60) ESR1ESR2CYP3A4LMNAHSD17B10
SCHEMBL6744335 0.87 ESR1 (0.60) ESR1ESR2CYP3A4LMNAHSD17B10
SCHEMBL3020449 0.86 ESR1 (0.70) ESR1ESR2CYP3A4LMNATYR
SCHEMBL3185263 0.84 KIF11 (0.58) ESR1ESR2KIF11ALDH1A1MEN1
SCHEMBL11706233 0.84 KIF11 (0.51) ESR1ESR2CYP3A4LMNAHSD17B10
SCHEMBL9164873 0.82 ESR1 (0.55) ESR1ESR2CYP3A4LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7648811-B2 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION (US) 2010-01-19 — — US disclosed
US-7396895-B2 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION (US) 2008-07-08 — — US disclosed
US-20080118853-A1 BRANCHED POLYARYLENE ETHERS AND PROCESSES FOR THE PREPARATION THEREOF XEROX CORPORATION (US) 2008-05-22 — — US disclosed
US-7067608-B2 Process for preparing branched polyarylene ethers XEROX CORPORATION (US) 2006-06-27 — — US disclosed
US-20050208416-A1 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION 2005-09-22 — — US disclosed
US-20050154178-A1 Process for preparing branched polyarylene ethers XEROX CORPORATION 2005-07-14 — — US disclosed
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