SCHEMBL21560533

SCHEMBL21560533

CC/C(=N\O)C(=O)c1ccc2c(c1)C(C)(C)c1cc(Sc3ccc(OC)cc3)ccc1-2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.39
▸ RXRA P19793 2/20 0.37
▸ RARB P10826 1/20 0.37
▸ RARG P13631 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ RXRG P48443 1/20 0.37
▸ PTGIR P43119 2/20 0.36
▸ CYP26A1 O43174 3/20 0.35
▸ CTBP2 P56545 1/20 0.35
▸ CHEK2 O96017 1/20 0.35
▸ CES2 O00748 1/20 0.34
▸ CES1 P23141 1/20 0.34
▸ ICAM1 P05362 1/20 0.34
▸ SELE P16581 1/20 0.34
▸ MTNR1A P48039 1/20 0.33
▸ MTNR1B P49286 1/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC7 Q8WUI4 1/20 0.33

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
SCHEMBL21553858 1.00 HTT (0.39) HTTRXRARARBRARGRXRB
SCHEMBL21552089 0.88 PKM (0.39) RXRARARBRARGRXRBRXRG
SCHEMBL21551940 0.81 MTNR1A (0.42) RXRARARBRARGRXRBRXRG
SCHEMBL21551946 0.74 CYP26A1 (0.35) HTTRXRARARBRARGRXRB
SCHEMBL7194873 0.74 HTT (0.67) HTTRXRARARBRARGRXRB
SCHEMBL20935052 0.74 HTT (0.67) HTTRXRARARBRARGRXRB
SCHEMBL7194878 0.74 HTT (0.67) HTTRXRARARBRARGRXRB
SCHEMBL21551952 0.73 HPGD (0.44) RXRARARBRARGRXRBRXRG
SCHEMBL21551842 0.72 HPGD (0.44) RXRARARBRARGRXRBRXRG
SCHEMBL21560724 0.71 RXRA (0.40) RXRARARBRARGRXRBRXRG

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
WO-2019216600-A1 NOVEL OXIME ESTER COMPOUND AND PHOTORESIST COMPOSITION COMPRISING SAME 주식회사 트리엘 (KR) 2019-11-14 — — WO disclosed
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