SCHEMBL9623591

SCHEMBL9623591

Oc1ccc(-c2c(Cl)cc(O)cc2Cl)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 14/20 0.57
ESR2 Q92731 12/20 0.57
HSD17B10 Q99714 2/20 0.54
TTR P02766 1/20 0.46
CYP3A4 P08684 1/20 0.46
HPGD P15428 1/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43

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
SCHEMBL2477255 0.85 ESR1 (0.74) ESR1ESR2HSD17B10TTRCYP3A4
SCHEMBL5948912 0.80 ESR1 (0.52) ESR1ESR2HSD17B10TTRCYP3A4
SCHEMBL5948484 0.79 ESR1 (0.50) ESR1ESR2HSD17B10TTRCYP3A4
SCHEMBL5948397 0.77 ESR1 (0.48) ESR1ESR2HSD17B10TTRCYP3A4
SCHEMBL7903999 0.76 ESR1 (0.63) ESR1ESR2HSD17B10TTRCA12
SCHEMBL3684267 0.76 ESR1 (0.70) ESR1ESR2HSD17B10
SCHEMBL8060796 0.76 HSD17B10 (0.65) ESR1ESR2HSD17B10TTRCYP3A4
SCHEMBL9645033 0.76 CA1 (0.52) ESR1ESR2HSD17B10CA12CA1
SCHEMBL30536550 0.74 ESR1 (0.55) ESR1ESR2HSD17B10TTRCA12
SCHEMBL15688276 0.74 ESR1 (0.47) ESR1ESR2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0212944-B1 MELT-PROCESSABLE AROMATIC COPOLYESTER Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1992-04-08 EP disclosed
US-4746721-A ENGINEERING PLASTICS KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1988-05-24 US disclosed
EP-0212944-A2 Melt-processable aromatic copolyester Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1987-03-04 EP disclosed