SCHEMBL19401581

SCHEMBL19401581

CCN[C@H](CNC(=O)CCN)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 5/20 0.43
▸ TLR2 O60603 2/20 0.40
▸ MMP9 P14780 3/20 0.36
▸ FAAH O00519 1/20 0.35
▸ FOLH1 Q04609 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ ASAH1 Q13510 1/20 0.34
▸ MMP8 P22894 1/20 0.34
▸ MMP12 P39900 1/20 0.34
▸ MMP14 P50281 1/20 0.34
▸ SLC6A5 Q9Y345 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ GGT1 P19440 1/20 0.33
▸ NOD1 Q9Y239 1/20 0.33

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
SCHEMBL17860113 0.82 MMP2 (0.45) MMP2TLR2MMP9FOLH1MAPT
SCHEMBL24061949 0.77 CYP2D6 (0.48) MMP2MMP9FOLH1MAPTMMP8
SCHEMBL3208515 0.77 — —
SCHEMBL31091273 0.74 MMP2 (0.49) MMP2MMP9FAAHFOLH1MMP8
SCHEMBL8517971 0.74 MMP2 (0.49) MMP2MMP9FAAHFOLH1MMP8
SCHEMBL28312053 0.74 GGT1 (0.47) FOLH1SLC6A5GGT1NOD1
SCHEMBL14770824 0.74 GGT1 (0.47) FOLH1SLC6A5GGT1NOD1
SCHEMBL20220900 0.72 TLR2 (0.45) MMP2TLR2FAAHASAH1SLC6A5
SCHEMBL1768641 0.72 MMP2 (0.53) MMP2
SCHEMBL1768636 0.72 MMP2 (0.53) MMP2

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-2017162663-A1 PRODRUGS OF CYTOTOXIC ACTIVE AGENTS HAVING ENZYMATICALLY CLEAVABLE GROUPS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-09-28 — — WO disclosed
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