SCHEMBL25449261

SCHEMBL25449261

CCC[C@@H]1NC(=O)[C@H](CCC)NC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MLNR O43193 6/20 0.35
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
GHSR Q92847 2/20 0.32
MMP1 P03956 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
TPSAB1 Q15661 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30

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
SCHEMBL13545642 1.00 ALDH1A1 (0.40) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL4610136 0.97
SCHEMBL4405242 0.91 MMP1 (0.38) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL14214481 0.89 KDM4E (0.34) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL14952820 0.89 GHSR (0.38) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL14320163 0.89 SMN1; SMN2 (0.38) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL12869910 0.85 HDAC8 (0.47) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL14457494 0.84 ALDH1A1 (0.52) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL8998181 0.82 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EMEN1MAPT
SCHEMBL931066 0.81

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-2023079362-A1 PROCESSABLE COMPOSITIONS AND USE FOR THE SAME RIPPLE THERAPEUTICS CORPORATION (CA) 2023-05-11 WO disclosed