SCHEMBL5598732

SCHEMBL5598732

Cc1[nH]cnc1C[C@H](NC(=O)[C@H](C)N)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 1/20 0.47
WDR5 P61964 3/20 0.42
KMT2A Q03164 3/20 0.42
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
CAPN1 P07384 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
DHFR P00374 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PGGT1B P53609 1/20 0.38
CTSL P07711 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
CTRB1 P17538 3/20 0.36
ACE P12821 2/20 0.36
XIAP P98170 1/20 0.36
ITGB2 P05107 1/20 0.36

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
SCHEMBL30002169 0.90 MME (0.46) WDR5KMT2ACTRB1ACEMME
SCHEMBL4589240 0.87 GABRR1 (0.41) GABRR1WDR5KMT2AHRH2HRH1
SCHEMBL2812795 0.87 GABRR1 (0.41) GABRR1WDR5KMT2AHRH2HRH1
SCHEMBL27842689 0.87 FNTA (0.44) FNTAFNTBPGGT1B
SCHEMBL5598811 0.87 SLC15A2 (0.52) GABRR1NOD1
SCHEMBL5598750 0.83 GABRR1 (0.48) GABRR1WDR5KMT2AHRH2HRH1
SCHEMBL7806464 0.80 CTRB1 (0.43) WDR5KMT2ATDP1CTSLCTSS
SCHEMBL2241941 0.78 SLC15A2 (0.43) GABRR1HRH2HRH1HRH4HRH3
SCHEMBL17308671 0.78 ACE (0.38) CTRB1ACEMMECPA1ACE2
SCHEMBL17308665 0.78 ACE (0.38) CTRB1ACEMMECPA1ACE2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022204461-A1 KITS, COMPOSITIONS, AND METHODS OF TREATING HAIR LOSS ANDREWS NICK (US) 2022-09-29 WO disclosed
US-7186687-B2 Compositions and methods for treatment of Psoriasis PROCYTE CORPORATION (US) 2007-03-06 US disclosed
EP-0765152-B1 STIMULATION OF HAIR GROWTH BY PEPTIDE-COPPER COMPLEXES PROCYTE CORP (US) 2001-11-07 EP disclosed