SCHEMBL18672811

SCHEMBL18672811

CC(C)CCCCOC(=O)C(N)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.37
▸ SLC7A5 Q01650 1/20 0.37
▸ DPP4 P27487 2/20 0.33
▸ BLM P54132 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ DPP8 Q6V1X1 1/20 0.33
▸ DPP9 Q86TI2 1/20 0.33
▸ DPP7 Q9UHL4 1/20 0.33
▸ PTPN1 P18031 1/20 0.32
▸ TSHR P16473 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SLC1A3 P43003 1/20 0.32
▸ SLC1A2 P43004 1/20 0.32
▸ SLC1A1 P43005 1/20 0.32
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNB4 P30926 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32
▸ PSMB5 P28074 1/20 0.31

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
SCHEMBL13224082 1.00 RARB (0.37) RARBSLC7A5DPP4BLMLMNA
SCHEMBL22390222 0.98 RARB (0.36) RARBSLC7A5DPP4BLMLMNA
SCHEMBL20919191 0.98 RARB (0.36) RARBSLC7A5DPP4BLMLMNA
SCHEMBL19387347 0.94 SLC7A5 (0.38) RARBSLC7A5DPP4BLMDPP8
SCHEMBL19387340 0.94 SLC7A5 (0.38) RARBSLC7A5DPP4BLMDPP8
SCHEMBL19750463 0.94 SLC7A5 (0.38) RARBSLC7A5DPP4BLMDPP8
SCHEMBL6368605 0.90 SLC7A5 (0.44) SLC7A5DPP4DPP8DPP9DPP7
SCHEMBL30058717 0.89 TP53 (0.38) RARBDPP4DPP8DPP9DPP7
SCHEMBL14095430 0.88 SLC7A5 (0.42) SLC7A5DPP4TSHRPSMB5
SCHEMBL26231092 0.88 SLC7A5 (0.42) SLC7A5DPP4TSHRPSMB5

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-9603895-B2 Cyclosporin analogues for preventing or treating hepatitis C infection ENANTA PHARMACEUTICALS, INC. (US) 2017-03-28 — — US disclosed
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