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SCHEMBL7867780

SCHEMBL7867780

N=C(N)NCCCC(NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)CN)C(=O)NC(Cc1ccc(O)cc1)C(=O)NCC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 17/20 0.58
▸ NPY1R P25929 10/20 0.58
▸ NPY5R Q15761 9/20 0.58
▸ NPY2R P49146 6/20 0.58
▸ CHRND Q07001 2/20 0.53
▸ CHRNA1 P02708 1/20 0.53
▸ CHRNG P07510 1/20 0.53
▸ CHRNB1 P11230 1/20 0.53

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
SCHEMBL7867793 1.00 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RCHRND
SCHEMBL7866090 0.92 CHRND (0.56) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL24122752 0.92 CHRND (0.56) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL7866097 0.92 CHRND (0.56) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL30521958 0.91 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RCHRND
SCHEMBL29630348 0.89 QRFPR (0.53) NPY4RNPY1RNPY5RNPY2RCHRND
SCHEMBL30309259 0.89 NPY4R (0.65) NPY4RNPY1RNPY5RNPY2RCHRND
SCHEMBL31232421 0.88 TFPI (0.56) NPY4RNPY1RNPY5RNPY2R
SCHEMBL31257079 0.88 NPY4R (0.64) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29735603 0.88 CHRND (0.56) CHRNDCHRNA1CHRNGCHRNB1

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