SCHEMBL28735229

SCHEMBL28735229

Cc1ccccc1OCc1c(C)cccc1C(=O)OC=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.47
▸ RXRA P19793 1/20 0.45
▸ RXRB P28702 1/20 0.45
▸ RXRG P48443 1/20 0.45
▸ SGMS2 Q8NHU3 1/20 0.45
▸ SLC22A12 Q96S37 1/20 0.44
▸ APEX1 P27695 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ NOTUM Q6P988 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL16385609 0.80 ALDH1A1 (0.56) RXRARXRBRXRGSGMS2SLC22A12
SCHEMBL11424472 0.77 TSHR (0.35) MEN1ESR1KMT2AESR2L3MBTL1
SCHEMBL31711359 0.77 NPC1 (0.49) MEN1ESR1KMT2AESR2L3MBTL1
SCHEMBL308092 0.77 NPC1 (0.49) MEN1ESR1KMT2AESR2L3MBTL1
SCHEMBL17788289 0.72 MRGPRX4 (0.51) NPSR1SGMS2SLC22A12L3MBTL1ALDH1A1
SCHEMBL16385271 0.71 RXRA (0.52) RXRARXRBRXRGSLC22A12APEX1
SCHEMBL17788298 0.71 SLC22A12 (0.48) NPSR1SGMS2SLC22A12KMT2AL3MBTL1
SCHEMBL16385607 0.71 RXRA (0.49) NPSR1RXRARXRBRXRGSGMS2
SCHEMBL17788315 0.71 MRGPRX4 (0.50) SLC22A12MEN1KMT2AALDH1A1LMNA
SCHEMBL16385008 0.71 ALDH1A1 (0.51) RXRARXRBRXRGL3MBTL1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110396054-B Green synthesis method of kresoxim-methyl 京博农化科技有限公司 2022-09-20 — — CN disclosed
CN-114478241-A Preparation method of arylformyl formic ether 山东京博生物科技有限公司 2022-05-13 — — CN disclosed
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