SCHEMBL30446089

SCHEMBL30446089

C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 1/20 0.42
▸ DPP7 Q9UHL4 1/20 0.39
▸ CTSC P53634 4/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CYP3A4 P08684 2/20 0.36
▸ CYP2D6 P10635 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ REN P00797 1/20 0.36
▸ PRCP P42785 1/20 0.35
▸ LTA4H P09960 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ KLK7 P49862 1/20 0.34
▸ CAPN1 P07384 2/20 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
SCHEMBL30446058 0.92 MEN1 (0.41) CALCRLDPP7CTSCMEN1KMT2A
SCHEMBL29746308 0.91 CALCRL (0.42) CALCRLDPP7CTSCMEN1KMT2A
SCHEMBL30511778 0.91 DPP7 (0.42) CALCRLDPP7CTSCMEN1KMT2A
SCHEMBL30423381 0.91 DPP7 (0.43) CALCRLDPP7CTSCMEN1KMT2A
SCHEMBL30423389 0.90 DPP7 (0.41) CALCRLDPP7CTSCMEN1KMT2A
SCHEMBL30974528 0.87 CALCRL (0.49) CALCRLCTSCRENKLK7
SCHEMBL30548100 0.86 DPP7 (0.42) CALCRLDPP7CTSCMEN1KMT2A
SCHEMBL29746425 0.85 DPP7 (0.43) CALCRLDPP7CTSCMEN1KMT2A
SCHEMBL30417335 0.84 MEN1 (0.41) CALCRLDPP7CTSCMEN1KMT2A
SCHEMBL30818043 0.84 MEN1 (0.43) CALCRLDPP7CTSCMEN1KMT2A

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-20230302123-A1 REPLICATION-DEFICIENT ADENOVIRUS LEIBNIZ-INSTITUT FÜR VIROLOGIE (DE) 2023-09-28 — — US disclosed
EP-4188939-A1 REPLICATION-DEFICIENT ADENOVIRUS Leibniz-Institut für Virologie (DE) 2023-06-07 — — EP disclosed
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