SCHEMBL22821604

SCHEMBL22821604

COC(C)(C)c1ccc(COC(C)(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 1/20 0.38
▸ APP P05067 1/20 0.36
▸ IDO1 P14902 4/20 0.34
▸ ESR1 P03372 3/20 0.34
▸ ESR2 Q92731 3/20 0.34
▸ NR4A2 P43354 1/20 0.33
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ AGXT P21549 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ PTPN1 P18031 1/20 0.30

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
SCHEMBL10357375 0.83 RORC (0.39) RORCAPPIDO1ESR1ESR2
SCHEMBL648537 0.82 AGXT (0.39) APPIDO1ESR1ESR2TRPV1
SCHEMBL1691492 0.81 APP (0.52) APPESR1ESR2NR4A2RXRA
SCHEMBL19220762 0.78 IDO1 (0.59) IDO1MAOBKMT2A
SCHEMBL43313 0.78 MAPK1 (0.46) RORCESR1ESR2MAPK1MEN1
SCHEMBL17320466 0.77 RORC (0.43) RORCESR1ESR2MAPK1MEN1
SCHEMBL19638101 0.76 AGXT (0.41) IDO1ESR1AGXT
SCHEMBL4421702 0.75 TSHR (0.46) IDO1MAOBAGXTMAPK1TP53
SCHEMBL15431874 0.75 IDO1 (0.57) APPIDO1MAOBAGXTTP53
SCHEMBL2289971 0.75 PPARG (0.43) RORCESR1ESR2MAPK1MEN1

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-20200401047-A1 UNDERLAYER FILM-FORMING COMPOSITION, PATTERN-FORMING METHOD, COPOLYMER, AND MONOMER FOR UNDERLAYER FILM-FORMING COMPOSITION Oji Holdings Corporation (JP) 2020-12-24 — — US disclosed
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