SCHEMBL25847264

SCHEMBL25847264

CCOC(C)CCC(=O)NCCC(C)(C)OCC

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
ESR1 P03372 4/20 0.31
GAA P10253 1/20 0.31
CASP2 P42575 1/20 0.30
CNR1 P21554 1/20 0.30
HPGD P15428 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
SCHEMBL20380968 0.86 ALDH1A1 (0.44) ALDH1A1ESR1GAACASP2CNR1
SCHEMBL20362595 0.81 CASP2 (0.47) ALDH1A1GAACASP2HPGD
SCHEMBL19776395 0.80 SIGMAR1 (0.37) ALDH1A1GAACASP2HPGD
SCHEMBL23126135 0.78 FAAH (0.45) ALDH1A1GAACASP2CNR1
SCHEMBL19245438 0.78 SMN1; SMN2 (0.41) ALDH1A1GAAHPGD
SCHEMBL20143551 0.78 ALDH1A1 (0.34) ALDH1A1GAACASP2
SCHEMBL17662624 0.78 HTT (0.38) ALDH1A1GAACNR1
SCHEMBL25896444 0.77 MEN1 (0.48)
SCHEMBL26618323 0.77 GAA (0.33) ALDH1A1GAACASP2
SCHEMBL26034556 0.77 ALDH1A1 (0.38) ALDH1A1GAACASP2CNR1HPGD

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-20230226193-A1 LIPID CONJUGATES FOR THE DELIVERY OF THERAPEUTIC AGENTS Arrowhead Pharmaceuticals, Inc. 2023-07-20 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-20230226193-A1 LIPID CONJUGATES FOR THE DELIVERY OF THERAPEUTIC AGENTS CPT1B, MUSK, MYLK2 ALDH1A1 1330/4885ESR1 4650/4885GAA 201/4885

“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.