SCHEMBL11807128

SCHEMBL11807128

CCCCCC(CCOc1ccc2c(c1)OCO2)CCC(C(=O)CC)C(=O)CC

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ TSHR P16473 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MAOB P27338 4/20 0.43
▸ MAOA P21397 1/20 0.42
▸ HPGD P15428 1/20 0.41
▸ TAS1R3 Q7RTX0 1/20 0.41
▸ TAS1R1 Q7RTX1 1/20 0.41

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
SCHEMBL11796564 0.87 MAOB (0.50) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL11803139 0.86 MAOB (0.49) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL11801874 0.86 MAOB (0.49) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL11800862 0.85 MAOB (0.51) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL11797278 0.83 MAPT (0.51) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL11799177 0.81 MAOB (0.47) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL11803335 0.80 L3MBTL1 (0.51) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL22221556 0.76 MAOB (0.64) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL984460 0.76 MAOB (0.68) MAPTRAB9AKDM4EMEN1KMT2A
SCHEMBL14382267 0.75 MAOB (0.62) MAPTRAB9AKDM4EMEN1KMT2A

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-3933837-A 3,4-Methylenedioxyphenoxy-alkyl diketones and keto-esters STERLING DRUG INC. (US) 1976-01-20 — — US disclosed
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