SCHEMBL26616331

SCHEMBL26616331

CC(C)(C)OC(=O)[C@H](CCCCN)NC(=O)CCCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.46
▸ SLC6A5 Q9Y345 1/20 0.45
▸ ITGB3 P05106 8/20 0.44
▸ ITGA2B P08514 8/20 0.44
▸ NMT1 P30419 4/20 0.43
▸ NMT2 O60551 3/20 0.43
▸ POLB P06746 1/20 0.42
▸ GNPAT O15228 1/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ NFKB1 P19838 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
SCHEMBL20450528 0.96 SLC6A5 (0.50) FOLH1SLC6A5ITGB3ITGA2BNMT1
SCHEMBL20450527 0.96 SLC6A5 (0.50) FOLH1SLC6A5ITGB3ITGA2BNMT1
SCHEMBL24630329 0.92 SLC6A5 (0.46) FOLH1SLC6A5ITGB3ITGA2BNMT1
SCHEMBL24630326 0.92 SLC6A5 (0.46) FOLH1SLC6A5ITGB3ITGA2BNMT1
SCHEMBL29336456 0.91 SLC6A5 (0.48) FOLH1SLC6A5NMT1NMT2POLB
SCHEMBL29072167 0.90 NMT1 (0.51) SLC6A5ITGB3ITGA2BNMT1NMT2
SCHEMBL24630065 0.90 NMT1 (0.51) SLC6A5ITGB3ITGA2BNMT1NMT2
SCHEMBL15706317 0.87 NOD1 (0.51) SLC6A5POLBKMT2A
SCHEMBL20450608 0.86 SLC6A5 (0.47) FOLH1SLC6A5NMT1NMT2POLB
SCHEMBL20450607 0.86 SLC6A5 (0.47) FOLH1SLC6A5NMT1NMT2POLB

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-4265605-A1 FIBROBLAST ACTIVATION PROTEIN INHIBITOR Boomray Pharmaceuticals Co., Ltd. (CN) 2023-10-25 — — EP disclosed
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