SCHEMBL10442659

SCHEMBL10442659

N[C@@H](Cc1ccc(O)cc1)C(=O)Oc1cc(Br)cc(Br)c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.51
▸ LNPEP Q9UIQ6 5/20 0.42
▸ ERAP2 Q6P179 4/20 0.42
▸ PCNA P12004 1/20 0.41
▸ HDAC8 Q9BY41 2/20 0.41
▸ TAAR1 Q96RJ0 2/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ ERAP1 Q9NZ08 1/20 0.39

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
SCHEMBL27920353 0.81 SLC7A5 (0.60) SLC7A5LNPEPERAP2PCNAHDAC8
SCHEMBL1047510 0.81 SLC7A5 (0.60) SLC7A5LNPEPERAP2PCNAHDAC8
SCHEMBL27974928 0.81 SLC7A5 (0.60) SLC7A5LNPEPERAP2PCNAHDAC8
SCHEMBL11370023 0.79 SLC7A5 (0.73) SLC7A5PCNA
SCHEMBL11520038 0.79 SLC7A5 (0.73) SLC7A5PCNA
SCHEMBL11676390 0.79 SLC7A5 (0.73) SLC7A5PCNA
SCHEMBL10978818 0.79 SLC7A5 (0.73) SLC7A5PCNA
SCHEMBL60228 0.79 SLC7A5 (0.73) SLC7A5PCNA
SCHEMBL1667022 0.79 SLC7A5 (0.73) SLC7A5PCNA
SCHEMBL8168147 0.79 SLC7A5 (0.73) SLC7A5PCNA

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-0349204-A2 Use and regeneration of reagents using coupled reactions and permselective barriers BEND RESEARCH, INC. (US) 1990-01-03 — — EP claimed
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