SCHEMBL29630536

SCHEMBL29630536

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

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ QRFPR Q96P65 3/20 0.42
▸ NMT1 P30419 5/20 0.38
▸ NMT2 O60551 4/20 0.38
▸ C3AR1 Q16581 1/20 0.38
▸ TLR2 O60603 1/20 0.36
▸ NOD1 Q9Y239 2/20 0.35
▸ SLC15A2 Q16348 1/20 0.35
▸ NPY1R P25929 1/20 0.34
▸ NPY2R P49146 1/20 0.34
▸ NPY4R P50391 1/20 0.34
▸ NPY5R Q15761 1/20 0.34
▸ GNPAT O15228 1/20 0.34
▸ TFPI P10646 1/20 0.34

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
SCHEMBL29630598 0.95 QRFPR (0.42) QRFPRNMT1NMT2C3AR1TLR2
SCHEMBL29875551 0.94 C3AR1 (0.40) QRFPRC3AR1NOD1SLC15A2NPY1R
SCHEMBL31127533 0.92 QRFPR (0.47) QRFPRNMT1NMT2TLR2NPY1R
SCHEMBL31636034 0.91 QRFPR (0.42) QRFPRNMT1NMT2C3AR1TLR2
SCHEMBL5606065 0.91 QRFPR (0.42) QRFPRNMT1NMT2C3AR1TLR2
SCHEMBL5606063 0.91 QRFPR (0.42) QRFPRNMT1NMT2C3AR1TLR2
SCHEMBL30826350 0.91 NPY4R (0.47) QRFPRNMT1NMT2NPY1RNPY2R
SCHEMBL30027024 0.90 NMT1 (0.44) QRFPRNMT1NMT2C3AR1TLR2
SCHEMBL31593243 0.89 SLC15A2 (0.43) QRFPRNMT1NMT2C3AR1TLR2
SCHEMBL30481161 0.88 NOD1 (0.43) QRFPRNOD1

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-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 — — US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 — — US disclosed
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