SCHEMBL20345279

SCHEMBL20345279

CC(C)C(CC(C)(C)C)C(=O)Oc1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 9/20 0.44
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ADRB2 P07550 2/20 0.38
▸ ADRB1 P08588 2/20 0.38
▸ ADRB3 P13945 2/20 0.38
▸ BCHE P06276 1/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL13924411 0.86 L3MBTL1 (0.55) ELANEATML3MBTL1ALDH1A1MEN1
SCHEMBL21505065 0.84 ELANE (0.46) ELANEATML3MBTL1BCHECHRM2
SCHEMBL12999209 0.83 ELANE (0.45) ELANEATML3MBTL1ADRB2ADRB1
SCHEMBL21291493 0.81 ELANE (0.42) ELANEATML3MBTL1MAPK1
SCHEMBL8827992 0.80 ELANE (0.43) ELANEATML3MBTL1BCHECHRM2
SCHEMBL25692946 0.79 ESR1 (0.34) ATML3MBTL1MAPK1ALDH1A1MEN1
SCHEMBL18842482 0.76 ELANE (0.51) ELANEATML3MBTL1ADRB2ADRB1
SCHEMBL13760103 0.75 GAA (0.35) L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL3678450 0.74 ELANE (0.48) ELANEATML3MBTL1KDM4EMEN1
SCHEMBL5186261 0.74 ELANE (0.68) ELANEKDM4EMEN1KMT2A

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-3343292-A1 CHEMICALLY AMPLIFIED NEGATIVE RESIST COMPOSITION AND RESIST PATTERN FORMING PROCESS Shin-Etsu Chemical Co., Ltd. (JP) 2018-07-04 — — EP disclosed
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