SCHEMBL21552089

SCHEMBL21552089

CCC(=NOC(C)=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
▸ PKM P14618 2/20 0.39
▸ PTGIR P43119 2/20 0.36
▸ RXRA P19793 2/20 0.35
▸ RARB P10826 1/20 0.35
▸ RARG P13631 1/20 0.35
▸ RXRB P28702 1/20 0.35
▸ RXRG P48443 1/20 0.35
▸ ICAM1 P05362 1/20 0.34
▸ SELE P16581 1/20 0.34
▸ CYP26A1 O43174 1/20 0.33
▸ CHEK2 O96017 1/20 0.33
▸ MAPT P10636 4/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SENP8 Q96LD8 1/20 0.32
▸ SENP7 Q9BQF6 1/20 0.32
▸ SENP6 Q9GZR1 1/20 0.32
▸ CES2 O00748 1/20 0.32
▸ CES1 P23141 1/20 0.32

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
SCHEMBL21560533 0.88 HTT (0.39) PTGIRRXRARARBRARGRXRB
SCHEMBL21553858 0.88 HTT (0.39) PTGIRRXRARARBRARGRXRB
SCHEMBL21551940 0.77 MTNR1A (0.42) PTGIRRXRARARBRARGRXRB
SCHEMBL14429953 0.77 PKM (0.57) PKMMAPTNPC1RAB9ACES2
SCHEMBL20935415 0.77 LMNA (0.44) PKMPTGIRCHEK2MAPTCES2
SCHEMBL21431091 0.73 PKM (0.33) PKMMAPTKMT2A
SCHEMBL21552136 0.73 ALDH1A1 (0.36) PKMRXRARARBRARGRXRB
SCHEMBL7202487 0.73 HTT (0.52) PKMPTGIRCHEK2MAPTGAA
SCHEMBL7202483 0.73 HTT (0.52) PKMPTGIRCHEK2MAPTGAA
SCHEMBL14429955 0.73 HPGD (0.50) PKMMAPTNPC1CASP3RAB9A

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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