SCHEMBL11991239

SCHEMBL11991239

CC(C)C(C)(C)C(=O)Oc1ccc(O)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 10/20 0.44
▸ ESR2 Q92731 10/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ JAK2 O60674 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ IDO1 P14902 6/20 0.41
▸ POLB P06746 1/20 0.40
▸ CHEK1 O14757 1/20 0.38
▸ ELANE P08246 1/20 0.37
▸ PKM P14618 1/20 0.37

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
SCHEMBL11991240 0.91 ESR1 (0.51) ESR1ESR2MEN1KMT2AJAK2
SCHEMBL18785662 0.84 ELANE (0.53) ESR1ESR2MEN1KMT2AJAK2
SCHEMBL22454743 0.81 ESR1 (0.46) ESR1ESR2MEN1KMT2AJAK2
SCHEMBL11991243 0.80 ALDH1A1 (0.54) MEN1KMT2AGAAHSD17B10ELANE
SCHEMBL15189295 0.79 ESR1 (0.49) ESR1ESR2MEN1KMT2AJAK2
SCHEMBL8737835 0.79 ESR1 (0.44) ESR1ESR2MEN1KMT2AJAK2
SCHEMBL18671905 0.77 ESR1 (0.42) ESR1ESR2MEN1KMT2AJAK2
Methylsulfanylmethane SCHEMBL5636396 0.76 ESR1 (0.44) ESR1ESR2MEN1KMT2AJAK2
SCHEMBL13161550 0.75 ESR1 (0.41) ESR1ESR2MEN1KMT2AJAK2
SCHEMBL27842430 0.75 ESR1 (0.53) ESR1ESR2MEN1KMT2AJAK2

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-20120214100-A1 RESIST COMPOSITION AND PATTERNING PROCESS USING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-08-23 — — US disclosed
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