SCHEMBL25818728

SCHEMBL25818728

NCCCc1cc(P)cc(OCC2CCCCC2)c1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 5/20 0.40
PARP15 Q460N3 4/20 0.39
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL27996082 0.84 PARP10 (0.43) PARP10PARP15
SCHEMBL25818767 0.84 PARP10 (0.40) PARP10PARP15THRATHRB
SCHEMBL2204138 0.84 PARP10 (0.45) PARP10PARP15THRATHRB
SCHEMBL19291538 0.84 PARP10 (0.42) PARP10PARP15THRATHRB
SCHEMBL2207625 0.84 PARP10 (0.42) PARP10PARP15THRATHRB
SCHEMBL1002808 0.80 TLR4 (0.46) PARP10PARP15
SCHEMBL2202527 0.80 TLR4 (0.46) PARP10PARP15
SCHEMBL2204247 0.80 TLR4 (0.46) PARP10PARP15
SCHEMBL30580721 0.80 TLR4 (0.46) PARP10PARP15
SCHEMBL2207362 0.78 SLC2A1 (0.44) PARP10PARP15

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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER PARP10 1846/4885PARP15 2575/4885THRA 3146/4885

“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.