SCHEMBL11647256

SCHEMBL11647256

C#CCOS(=O)OC(C)COc1ccccc1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.41
▸ ADRB2 P07550 4/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ADRB1 P08588 1/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KDM4E B2RXH2 4/20 0.38
▸ HTR7 P34969 2/20 0.37
▸ PKM P14618 1/20 0.37
▸ DRD1 P21728 1/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ MAOA P21397 1/20 0.36

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
SCHEMBL11648674 0.87 ADRB2 (0.39) ADRB2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL11645050 0.86 MAOB (0.39) MAOBADRB2ALDH1A1SMN1; SMN2MEN1
SCHEMBL11649321 0.86 ADRB2 (0.48) ADRB2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL11648973 0.83 ADRB2 (0.43) MAOBADRB2ALDH1A1SMN1; SMN2MEN1
SCHEMBL11648961 0.81 MAOB (0.36) MAOBADRB2ALDH1A1SMN1; SMN2MEN1
SCHEMBL11647880 0.79 TP53 (0.47) MAOBADRB2ALDH1A1SMN1; SMN2MEN1
SCHEMBL11647260 0.79 MAOB (0.36) MAOBADRB2ALDH1A1SMN1; SMN2MEN1
SCHEMBL11649316 0.78 ADRB2 (0.48) ADRB2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL11650319 0.77 MAOB (0.34) MAOBADRB2ALDH1A1SMN1; SMN2MEN1
SCHEMBL11648964 0.76 ADRB2 (0.50) MAOBADRB2ALDH1A1SMN1; SMN2MEN1

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
US-4104401-A Control of insects and acarids with alkynyl phenylphenol divalent aliphatic sulfites UNIROYAL, INC. (US) 1978-08-01 — — US claimed
US-4003940-A INSECTICIDES, ACARICIDES UNIROYAL INC. (US) 1977-01-18 — — US claimed
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