SCHEMBL7866097

SCHEMBL7866097

NCCCC[C@H](NC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRND Q07001 6/20 0.56
CHRNA1 P02708 2/20 0.56
CHRNG P07510 2/20 0.56
CHRNB1 P11230 2/20 0.56
GRIA1 P42261 5/20 0.52
GRIA2 P42262 1/20 0.52

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
SCHEMBL7866090 1.00 CHRND (0.56) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL24122752 1.00 CHRND (0.56) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL29735603 0.96 CHRND (0.56) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL30471344 0.93 NPY4R (0.55) CHRND
SCHEMBL7867780 0.92 NPY4R (0.58) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL7867793 0.92 NPY4R (0.58) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL26179142 0.92 CHRND (0.54) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL30138974 0.91 CALCRL (0.55) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL29479574 0.91 OPRD1 (0.51) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL7122844 0.89 SLC15A2 (0.59) CHRNDCHRNA1CHRNGCHRNB1GRIA1

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
US-6303116-B1 CAPABLE OF TRANSDUCING THERAPEUTIC GENES INTO NON-DIVIDING CELLS. THOMAS JEFFERSON UNIVERSITY 2001-10-16 US disclosed