SCHEMBL22154657

SCHEMBL22154657

Cc1ccc(C[C@H](N)CC(C)(C)C(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 2/20 0.41
▸ ENPEP Q07075 2/20 0.41
▸ MME P08473 1/20 0.41
▸ GRB2 P62993 1/20 0.39
▸ PPARA Q07869 2/20 0.38
▸ PPARG P37231 1/20 0.38
▸ FFAR1 O14842 2/20 0.38
▸ KIF11 P52732 2/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ SLC7A5 Q01650 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ EPHX1 P07099 1/20 0.37
▸ PSMB8 P28062 1/20 0.37
▸ PSMB5 P28074 1/20 0.37

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
SCHEMBL22154816 1.00 ANPEP (0.41) ANPEPENPEPMMEGRB2PPARA
SCHEMBL27124358 0.87 SLC7A5 (0.53) ANPEPENPEPMMESLC7A5
SCHEMBL24140474 0.87 SLC7A5 (0.53) ANPEPENPEPMMESLC7A5
SCHEMBL25818343 0.87 ENPEP (0.41) ANPEPENPEPMMEGRB2MMP2
SCHEMBL25831733 0.87 ENPEP (0.41) ANPEPENPEPMMEGRB2MMP2
SCHEMBL17728727 0.87 EPHX1 (0.53) ANPEPMMEMMP2SLC7A5EPHX1
SCHEMBL17728729 0.87 EPHX1 (0.53) ANPEPMMEMMP2SLC7A5EPHX1
SCHEMBL28208789 0.87 EPHX1 (0.53) ANPEPMMEMMP2SLC7A5EPHX1
SCHEMBL22121182 0.86 MME (0.44) ANPEPENPEPMMEGRB2HPGD
SCHEMBL22154239 0.86 MME (0.44) ANPEPENPEPMMEGRB2HPGD

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
WO-2020132658-A2 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES REGENERON PHARMACEUTICALS, INC. (US) 2020-06-25 — — WO disclosed
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