SCHEMBL29630328

SCHEMBL29630328

C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.46
▸ NPY1R P25929 9/20 0.46
▸ NPY5R Q15761 8/20 0.46
▸ NPY2R P49146 5/20 0.46
▸ TUBB4A P04350 1/20 0.41
▸ TUBB P07437 1/20 0.41
▸ TUBA3C P0DPH7 1/20 0.41
▸ TUBA1B P68363 1/20 0.41
▸ TUBA4A P68366 1/20 0.41
▸ TUBB4B P68371 1/20 0.41
▸ TUBB3 Q13509 1/20 0.41
▸ TUBB2A Q13885 1/20 0.41
▸ TUBB8 Q3ZCM7 1/20 0.41
▸ TUBA3E Q6PEY2 1/20 0.41
▸ TUBA1A Q71U36 1/20 0.41
▸ TUBA1C Q9BQE3 1/20 0.41
▸ TUBB6 Q9BUF5 1/20 0.41
▸ TUBB2B Q9BVA1 1/20 0.41
▸ TUBB1 Q9H4B7 1/20 0.41
▸ CTSL P07711 3/20 0.39

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
SCHEMBL29531505 0.98 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2RTUBB4A
SCHEMBL29452752 0.93 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2RTUBB4A
SCHEMBL31453814 0.93 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2RTUBB4A
SCHEMBL29609505 0.92 NPY4R (0.59) NPY4RNPY1RNPY5RNPY2RTUBB4A
SCHEMBL31453810 0.92 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2RTUBB4A
SCHEMBL30515238 0.91 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30272461 0.91 NPY4R (0.44) NPY4RNPY1RNPY5RNPY2RTUBB4A
SCHEMBL31088231 0.89 NPY4R (0.49) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29736425 0.89 NPY4R (0.49) NPY4RNPY1RNPY5RNPY2R
SCHEMBL1071152 0.89 NPY4R (0.41) NPY4RNPY1RNPY5RNPY2R

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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