SCHEMBL26965341

SCHEMBL26965341

CC(C)C[C@@H](CCO)NC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.42
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
FOLH1 Q04609 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
MME P08473 4/20 0.36
RNPEP Q9H4A4 3/20 0.35
SLC7A5 Q01650 1/20 0.35
KISS1R Q969F8 1/20 0.35
MAPT P10636 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
ANPEP P15144 2/20 0.34
DNPEP Q9ULA0 1/20 0.34

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
SCHEMBL27120254 1.00 PLA2G10 (0.42) PLA2G10ALDH1A1LMNAMEN1KMT2A
SCHEMBL28681574 0.83 PLA2G10 (0.50) PLA2G10ALDH1A1LMNAMEN1KMT2A
SCHEMBL27905207 0.83 ALDH1A1 (0.48) PLA2G10ALDH1A1LMNAMEN1KMT2A
SCHEMBL25291547 0.83 ALDH1A1 (0.42) PLA2G10ALDH1A1LMNAMEN1KMT2A
SCHEMBL27651567 0.83 ALDH1A1 (0.42) PLA2G10ALDH1A1LMNAMEN1KMT2A
SCHEMBL3306198 0.83 ALDH1A1 (0.42) PLA2G10ALDH1A1LMNAMEN1KMT2A
SCHEMBL34469833 0.82 ALDH1A1 (0.31) ALDH1A1FOLH1
Benzene SCHEMBL28850626 0.79 CNR1 (0.43) ALDH1A1LMNAMEN1KMT2AMME
SCHEMBL16329867 0.78 TAS1R3 (0.44) PLA2G10ALDH1A1LMNAMEN1KMT2A
SCHEMBL4284738 0.78 CA2 (0.39) LMNATAS1R3TAS1R1

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-20230406860-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE AMGEN INC. 2023-12-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230406860-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE KRAS, NRAS, HRAS PLA2G10 2367/4885ALDH1A1 1457/4885LMNA 2655/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.