SCHEMBL30612980

SCHEMBL30612980

CC(C)C(C)(C)N[C@@H](CS)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACE P12821 7/20 0.48
KDM4E B2RXH2 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
ALOX15 P16050 1/20 0.48
NFKB1 P19838 1/20 0.48
PTGS2 P35354 1/20 0.48
THPO P40225 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
FOLH1 Q04609 3/20 0.38
PIK3CD O00329 1/20 0.37
NAALAD2 Q9Y3Q0 2/20 0.34
ENPEP Q07075 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33

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
SCHEMBL3923217 0.81 MAPT (0.54) ACEKDM4EMAPTTHRBALOX15
SCHEMBL560423 0.81 MAPT (0.54) ACEKDM4EMAPTTHRBALOX15
SCHEMBL560422 0.81 MAPT (0.54) ACEKDM4EMAPTTHRBALOX15
SCHEMBL1396850 0.78 MAPT (0.50) ACEKDM4EMAPTTHRBALOX15
SCHEMBL24513378 0.74 KDM4E (0.47) ACEKDM4EMAPTTHRBALOX15
SCHEMBL2932256 0.73 KDM4E (0.50) ACEKDM4EMAPTTHRBALOX15
SCHEMBL24668415 0.73 KDM4E (0.55) ACEKDM4EMAPTTHRBALOX15
SCHEMBL977947 0.72 KDM4E (0.48) ACEKDM4EMAPTTHRBALOX15
SCHEMBL28606489 0.72 KDM4E (0.48) ACEKDM4EMAPTTHRBALOX15
SCHEMBL976009 0.72 KDM4E (0.48) ACEKDM4EMAPTTHRBALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4302981-B1 OBJECT MADE BY ADDITIVE MANUFACTURING DEMCON BOND 3D B V (NL) 2026-05-06 EP disclosed
US-11994384-B2 Method for radially aligning wheelsets of rail vehicles HEGENSCHEIDT-MFD GMBH (DE) 2024-05-28 US disclosed
EP-4302981-A2 OBJECT MADE BY ADDITIVE MANUFACTURING Bond high performance 3D technology B.V. (NL) 2024-01-10 EP disclosed
EP-3589479-B1 OBJECT MADE BY ADDITIVE MANUFACTURING BOND HIGH PERFORMANCE 3D TECH B V (NL) 2023-11-29 EP disclosed