SCHEMBL11099488

SCHEMBL11099488

CC(C)(C)N(CC(=O)c1ccc(O)c(C(N)=O)c1)Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.40
▸ ACHE P22303 1/20 0.39
▸ ADRB2 P07550 3/20 0.38
▸ ADRB1 P08588 3/20 0.38
▸ ADRA1D P25100 3/20 0.38
▸ ADRA1A P35348 3/20 0.38
▸ ADRA1B P35368 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HPGD P15428 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ ADRA2A P08913 2/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38

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
SCHEMBL9863678 0.86 LMNA (0.45) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL32681774 0.84 PPARG (0.48) LMNAACHEADRB2ADRB1ADRA1D
SCHEMBL11197070 0.84 PPARG (0.48) LMNAACHEADRB2ADRB1ADRA1D
SCHEMBL14445127 0.82 PKM (0.47) LMNAACHEADRB2ALDH1A1HPGD
SCHEMBL32668832 0.82 PKM (0.47) LMNAACHEADRB2ALDH1A1HPGD
Hydrochloric Acid SCHEMBL31199080 0.81 PKM (0.46) LMNAACHEADRB2ALDH1A1HPGD
SCHEMBL11594746 0.78 HTT (0.47) ACHEKDM4EALDH1A1HPGDSMN1; SMN2
Bromide SCHEMBL29484430 0.77 LMNA (0.42) LMNAACHEALDH1A1OPRM1TSHR
SCHEMBL28662419 0.77 KDM4E (0.48) LMNAACHEADRB2ADRB1ADRA1D
SCHEMBL29710397 0.77 KDM4E (0.48) LMNAACHEADRB2ADRB1ADRA1D

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
EP-0103830-A2 Phenylethylemine derivatires as growth stimulators BAYER AG (DE) 1984-03-28 — — EP disclosed
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