SCHEMBL20274282

SCHEMBL20274282

CC(C)(CI)C(=O)Oc1cccc2c(O)cccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 13/20 0.52
▸ ESR2 Q92731 13/20 0.52
▸ KMT2A Q03164 7/20 0.50
▸ MEN1 O00255 6/20 0.50
▸ GAA P10253 5/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ JAK2 O60674 1/20 0.50
▸ USP2 O75604 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ POLB P06746 2/20 0.48
▸ RAB9A P51151 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ELANE P08246 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ FABP7 O15540 2/20 0.35
▸ FABP3 P05413 2/20 0.35

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
SCHEMBL92373 0.87 ESR1 (0.51) ESR1ESR2KMT2AMEN1GAA
SCHEMBL18785883 0.83 ESR1 (0.57) ESR1ESR2KMT2AMEN1GAA
SCHEMBL18671983 0.81 ESR1 (0.49) ESR1ESR2KMT2AMEN1GAA
SCHEMBL14220068 0.78 ESR1 (0.49) ESR1ESR2KMT2AMEN1GAA
SCHEMBL11991240 0.78 ESR1 (0.51) ESR1ESR2KMT2AMEN1GAA
SCHEMBL8737835 0.78 ESR1 (0.44) ESR1ESR2KMT2AMEN1GAA
SCHEMBL14477152 0.77 ESR1 (0.48) ESR1ESR2KMT2AMEN1GAA
SCHEMBL2736403 0.77 ESR1 (0.42) ESR1ESR2KMT2AMEN1GAA
SCHEMBL15189295 0.75 ESR1 (0.49) ESR1ESR2KMT2AMEN1GAA
SCHEMBL25139350 0.75 ESR1 (0.46) ESR1ESR2KMT2AMEN1GAA

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
EP-3203319-B1 POLYMER COMPOUND, NEGATIVE RESIST COMPOSITION, LAMINATE, PATTERNING PROCESS, AND COMPOUND SHINETSU CHEMICAL CO (JP) 2018-06-20 — — EP disclosed
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