SCHEMBL29576017

SCHEMBL29576017

O=C(N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O)[C@@H]1CCCN1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 2/20 0.42
▸ ACE P12821 6/20 0.40
▸ REN P00797 5/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ F2 P00734 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ LTA4H P09960 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PEPD P12955 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ HRH1 P35367 1/20 0.40
▸ THPO P40225 1/20 0.40
▸ PMP22 Q01453 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ ACE2 Q9BYF1 1/20 0.40
▸ TRHR P34981 1/20 0.38
▸ TGM2 P21980 1/20 0.38

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
SCHEMBL30452849 0.96 ACE (0.43) ACERENKDM4EF2LMNA
SCHEMBL29380028 0.95 ACE (0.46) CAPN1ACERENKDM4EF2
SCHEMBL30116355 0.94 ACE (0.43) CAPN1ACERENKDM4EF2
SCHEMBL29765228 0.91 CAPN1 (0.44) CAPN1ACERENKDM4EF2
SCHEMBL29765176 0.89 CAPN1 (0.47) CAPN1ACERENKDM4EF2
SCHEMBL29765170 0.89 CAPN1 (0.47) CAPN1ACERENKDM4EF2
SCHEMBL29765105 0.89 CAPN1 (0.47) CAPN1ACERENKDM4EF2
SCHEMBL29765249 0.89 CAPN1 (0.47) CAPN1ACERENKDM4EF2
SCHEMBL29765258 0.89 CAPN1 (0.47) CAPN1ACERENKDM4EF2
SCHEMBL30817465 0.86 ACE (0.52) ACERENKDM4EF2LMNA

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
US-11312974-B2 Gene for increasing plant biomass and use therefor KANEKA CORPORATION (JP) 2022-04-26 — — US disclosed
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