SCHEMBL11224090

SCHEMBL11224090

CC(=O)Oc1c(Cl)cccc1OCCCCCOc1cccc(Cl)c1OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ PTPN1 P18031 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HPGD P15428 1/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ HTR2B P41595 1/20 0.40
▸ SLC6A3 Q01959 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
SCHEMBL6937651 0.83 MAPK1 (0.61) MAPK1KMT2AL3MBTL1PTPN1MAPT
SCHEMBL28782497 0.80 MAPK1 (0.49) MAPK1KMT2AL3MBTL1PTPN1MEN1
SCHEMBL9419436 0.80 MAPK1 (0.71) MAPK1KMT2AL3MBTL1MEN1MAPT
SCHEMBL3006462 0.79 KDM4E (0.48) MAPK1KMT2AL3MBTL1MAPTTDP1
SCHEMBL9419449 0.78 MAPK1 (0.73) MAPK1KMT2AL3MBTL1MEN1MAPT
SCHEMBL9326165 0.77 KDM4E (0.47) MAPK1KMT2AL3MBTL1MAPTTDP1
SCHEMBL11237890 0.77 KDM4E (0.42) KMT2AMEN1MAPTTDP1LMNA
SCHEMBL19612363 0.76 L3MBTL1 (0.54) MAPK1KMT2AL3MBTL1MEN1MAPT
SCHEMBL10499349 0.75 LMNA (0.48) MAPK1KMT2AL3MBTL1MAPTTDP1
SCHEMBL9713918 0.75 CNR1 (0.41) KMT2AMEN1MAPTPTGS2LMNA

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-4320144-A Fungicidal use of diphenyl esters of alkylenes GAF CORPORATION (US) 1982-03-16 — — US disclosed
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