SCHEMBL23784440

SCHEMBL23784440

CCC(C)C(=O)OCCOc1ccc(/N=N/c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 6/20 0.50
▸ PPARD Q03181 4/20 0.50
▸ LMNA P02545 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ MAPT P10636 3/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ PPARG P37231 3/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MTNR1A P48039 1/20 0.41
▸ MTNR1B P49286 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ FAAH O00519 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CES2 O00748 1/20 0.40

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
SCHEMBL23784437 0.93 PPARA (0.46) PPARAPPARDKMT2AMEN1MAPT
SCHEMBL23784438 0.92 PPARA (0.46) PPARAPPARDTP53KMT2AMEN1
SCHEMBL23784447 0.92 PPARA (0.46) PPARAPPARDTP53KMT2AMEN1
SCHEMBL17122045 0.89 PPARA (0.53) PPARAPPARDLMNATP53KMT2A
SCHEMBL14791147 0.89 PPARA (0.53) PPARAPPARDLMNATP53KMT2A
SCHEMBL14791143 0.86 PPARA (0.53) PPARAPPARDALDH1A1MAPTRAB9A
SCHEMBL10050663 0.85 MAPT (0.50) LMNATP53KMT2AALDH1A1MEN1
SCHEMBL17131747 0.83 MAPT (0.46) PPARAPPARDKMT2AALDH1A1MAPT
SCHEMBL14791144 0.83 PPARA (0.50) PPARAPPARDALDH1A1MAPTRAB9A
SCHEMBL10030184 0.80 ALDH1A1 (0.43) TP53KMT2AALDH1A1MEN1MAPT

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-11111437-B2 Liquid crystal composition, optically anisotropic layer, optical laminate, and image display device FUJIFILM CORPORATION (JP) 2021-09-07 — — US disclosed
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