SCHEMBL28557048

SCHEMBL28557048

CCCC(N)NC(CS)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ PTGS2 P35354 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ACE P12821 1/20 0.42
▸ FOLH1 Q04609 1/20 0.40
▸ GRIK1 P39086 1/20 0.39
▸ SLC1A3 P43003 1/20 0.39
▸ SLC1A2 P43004 1/20 0.39
▸ SLC1A1 P43005 1/20 0.39
▸ GRIK2 Q13002 1/20 0.39
▸ PTGS1 P23219 2/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ AKR1A1 P14550 1/20 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
SCHEMBL7393926 0.85 KDM4E (0.48) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL4996805 0.85 KDM4E (0.48) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL8498730 0.85 KDM4E (0.48) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL18691134 0.77 ENPEP (0.56) FOLH1PTGS1ENPEPGSTK1ANPEP
SCHEMBL107698 0.76 KDM4E (0.52) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL1428936 0.76 KDM4E (0.52) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL31679398 0.75 ACE (0.56) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL28705433 0.75 CHRM1 (0.43) ACEGRIK1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL1574245 0.75 ACE (0.50) KDM4EMAPTTHRBALOX15NFKB1
Hydrochloric Acid SCHEMBL19332925 0.75 ACE (0.50) KDM4EMAPTTHRBALOX15NFKB1

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
CN-112546244-A Fibroblast growth factor receptor2 specific peptide reagents and methods 密执安州立大学董事会 2021-03-26 — — CN disclosed
Send feedback