SCHEMBL10913686

SCHEMBL10913686

Cc1cccc(C(=S)OC2=C(c3ccc(C)cc3C)C(=O)CC(C)(C)C2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ MAPT P10636 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ PGR P06401 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PARP1 P09874 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ POLB P06746 3/20 0.32
▸ HPGD P15428 2/20 0.32
▸ GABRD O14764 1/20 0.32
▸ GABRA1 P14867 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
SCHEMBL11093637 0.81 BRD4 (0.38) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL11098815 0.80 TP53 (0.35) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL11098282 0.79 BRD4 (0.37) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL11096758 0.79 KDM4E (0.34) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10729870 0.78 MAPT (0.45) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL11097162 0.77 BRD4 (0.40) KMT2AMAPTALDH1A1PGRKDM4E
SCHEMBL11098604 0.76 BRD4 (0.35) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10735397 0.76 KDM4E (0.37) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL11094187 0.76 MAPK1 (0.35) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10909040 0.75 BRD4 (0.34) KMT2AMAPTALDH1A1KDM4EMEN1

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-4613617-A Synergistic insecticidal compositions containing dione esters UNION CARBIDE CORPORATION (US) 1986-09-23 — — 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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