SCHEMBL10737255

SCHEMBL10737255

CCN(CC)c1cccc(C(=O)OC2=C(c3ccccc3Cl)C(=O)CC(C)(C)C2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ALDH1A1 P00352 6/20 0.32
▸ KDM4E B2RXH2 5/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ LMNA P02545 3/20 0.32
▸ HTT P42858 1/20 0.32
▸ MAPT P10636 3/20 0.32
▸ HPGD P15428 1/20 0.32
▸ GHSR Q92847 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
SCHEMBL10731442 0.84 KMT2A (0.41) KMT2ASMN1; SMN2ALDH1A1HSD17B10GSK3B
SCHEMBL10735327 0.80 KMT2A (0.51) KMT2ASMN1; SMN2ALDH1A1GAATDP1
SCHEMBL10911015 0.76 STK10 (0.42) KMT2ASMN1; SMN2ALDH1A1KDM4EGSK3B
SCHEMBL10731396 0.76 LMNA (0.41) KMT2ASMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL10730784 0.74 LMNA (0.38) KMT2ASMN1; SMN2ALDH1A1TDP1LMNA
SCHEMBL10736061 0.70 GAA (0.39) SMN1; SMN2GAALMNAL3MBTL1NPSR1
SCHEMBL10736443 0.70 KMT2A (0.49) KMT2ASMN1; SMN2ALDH1A1GAATDP1
SCHEMBL10913322 0.69 KMT2A (0.35) KMT2ASMN1; SMN2KDM4EALOX15LMNA
SCHEMBL10732412 0.66 MAPK1 (0.40) KMT2ASMN1; SMN2ALDH1A1GAARECQL
SCHEMBL11522683 0.65 LOXL2 (0.53) KMT2ASMN1; SMN2ALDH1A1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4659372-A MITICIDE, MITE OVICIDE, AND HERBICIDES UNION CARBIDE CORPORATION (US) 1987-04-21 — — US disclosed
US-4422870-A MITICIDE, MITE OVICIDE, HERBICIDE UNION CARBIDE CORPORATION (US) 1983-12-27 — — US disclosed
US-4175135-A Method of controlling acarina ectoparasites on warmblooded animals by orally administering to the animal an ectoparasitically effective amount of a 2-aryl-1,3-cyclohexanedione compound, and alkali metal salts, ammonium salts and enol esters thereof UNION CARBIDE CORPORATION (US) 1979-11-20 — — US disclosed
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