SCHEMBL29437943

SCHEMBL29437943

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.43
▸ MAPK9 P45984 1/20 0.43
▸ MAPK10 P53779 1/20 0.43
▸ NPY4R P50391 10/20 0.43
▸ NPY1R P25929 7/20 0.43
▸ NPY5R Q15761 6/20 0.43
▸ NPY2R P49146 3/20 0.43
▸ KEAP1 Q14145 1/20 0.41
▸ EED O75530 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PRCP P42785 1/20 0.40

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
SCHEMBL8720811 0.96 MAPK8 (0.44) MAPK8MAPK9MAPK10NPY4RNPY1R
SCHEMBL8720817 0.96 MAPK8 (0.44) MAPK8MAPK9MAPK10NPY4RNPY1R
SCHEMBL29663559 0.95 MAPK8 (0.46) MAPK8MAPK9MAPK10NPY4RNPY1R
SCHEMBL30974427 0.93 KDM1A (0.43) MAPK8MAPK9MAPK10NPY4RNPY1R
SCHEMBL29687469 0.93 MAPK8 (0.48) MAPK8MAPK9MAPK10NPY4RNPY1R
SCHEMBL29947667 0.92 EED (0.41) MAPK8MAPK9MAPK10EEDMEN1
SCHEMBL29496543 0.92 MEN1 (0.44) MAPK8MAPK9MAPK10KEAP1MEN1
SCHEMBL31019315 0.90 PRCP (0.41) MAPK8MAPK9MAPK10NPY4RNPY1R
SCHEMBL30422922 0.90 MAPK8 (0.50) MAPK8MAPK9MAPK10NPY4RNPY1R
SCHEMBL31097719 0.90 KDM1A (0.47) MAPK8MAPK9MAPK10NPY4RNPY1R

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
WO-2022025093-A1 CANCER PEPTIDE VACCINE AND METHOD FOR PRODUCING SAME ブライトパス・バイオ株式会社 2022-02-03 — — WO disclosed
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