SCHEMBL2159831

SCHEMBL2159831

NCCCC[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)CN)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.42
▸ TLR2 O60603 1/20 0.39
▸ SLC6A5 Q9Y345 1/20 0.39
▸ F2 P00734 1/20 0.39
▸ FOLH1 Q04609 1/20 0.39
▸ QRFPR Q96P65 6/20 0.38
▸ NMT2 O60551 1/20 0.37
▸ NMT1 P30419 1/20 0.37
▸ SLC15A2 Q16348 1/20 0.37
▸ SIRT6 Q8N6T7 1/20 0.37
▸ SIRT1 Q96EB6 1/20 0.37
▸ ROCK2 O75116 3/20 0.36
▸ PRKACA P17612 1/20 0.36
▸ AKT3 Q9Y243 1/20 0.36
▸ TERT O14746 2/20 0.35

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
SCHEMBL15302247 1.00 HPGDS (0.42) HPGDSTLR2SLC6A5F2FOLH1
SCHEMBL22133062 1.00 HPGDS (0.42) HPGDSTLR2SLC6A5F2FOLH1
SCHEMBL1352085 0.98 HPGDS (0.43) HPGDSTLR2SLC6A5F2FOLH1
SCHEMBL26426329 0.89 QRFPR (0.42) HPGDSTLR2QRFPRSIRT6SIRT1
SCHEMBL24065513 0.89 SIRT6 (0.42) HPGDSTLR2SLC6A5F2FOLH1
SCHEMBL20013183 0.88 SIRT6 (0.44) HPGDSTLR2SLC6A5F2FOLH1
SCHEMBL24757204 0.88 HPGDS (0.41) HPGDSTLR2SLC6A5F2FOLH1
SCHEMBL8821210 0.88 FOLH1 (0.53) SLC6A5F2FOLH1SLC15A2
SCHEMBL29893406 0.88 FOLH1 (0.53) SLC6A5F2FOLH1SLC15A2
SCHEMBL8821211 0.88 FOLH1 (0.53) SLC6A5F2FOLH1SLC15A2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7985402-B2 Ultrasound contrast agent of peptide monomers; peptide vectors having high KDR binding affinity; gas filled microvesicle containing a fluorinated gas and a phospholipid BRACCO SUISSE SA (CH) 2011-07-26 — — US disclosed
US-20080152594-A1 TARGETING VECTOR-PHOSPHOLIPID CONJUGATES BRACCO SUISSE SA (CH) 2008-06-26 — — US disclosed
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