SCHEMBL25846567

SCHEMBL25846567

OC(CO/N=C(\Cl)c1ccc[n+](O)c1)CN1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSF1 Q00613 14/20 0.53
CYP2D6 P10635 1/20 0.46
TSHR P16473 1/20 0.46
HIF1A Q16665 1/20 0.46
ABCB1 P08183 3/20 0.45
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.43

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
SCHEMBL21091547 1.00 HSF1 (0.53) HSF1CYP2D6TSHRHIF1AABCB1
Arimoclomol SCHEMBL12254223 0.88 HSF1 (0.54) HSF1CYP2D6TSHRHIF1AABCB1
Arimoclomol SCHEMBL2324741 0.88 HSF1 (0.54) HSF1CYP2D6TSHRHIF1AABCB1
Arimoclomol SCHEMBL1896428 0.88 HSF1 (0.54) HSF1CYP2D6TSHRHIF1AABCB1
Arimoclomol SCHEMBL25257807 0.88 HSF1 (0.54) HSF1CYP2D6TSHRHIF1AABCB1
Arimoclomol SCHEMBL25258754 0.88 HSF1 (0.54) HSF1CYP2D6TSHRHIF1AABCB1
Arimoclomol SCHEMBL12254225 0.88 HSF1 (0.54) HSF1CYP2D6TSHRHIF1AABCB1
Arimoclomol SCHEMBL196123 0.88 HSF1 (0.54) HSF1CYP2D6TSHRHIF1AABCB1
Arimoclomol SCHEMBL5699241 0.88 HSF1 (0.54) HSF1CYP2D6TSHRHIF1AABCB1
SCHEMBL6009202 0.87 HSF1 (0.65) HSF1CYP2D6TSHRHIF1AABCB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240024306-A1 PROCESSES FOR PREPARING ARIMOCLOMOL CITRATE AND INTERMEDIATES THEREOF ZEVRA DENMARK AS (DK) 2024-01-25 US disclosed
US-11707456-B2 Processes for preparing arimoclomol citrate and intermediates thereof KEMPHARM DENMARK A/S 2023-07-25 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 (2 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-11707456-B2 Processes for preparing arimoclomol citrate and intermediates thereof ACLY, AURKC, AURKA HSF1 4634/4885CYP2D6 1564/4885TSHR 4655/4885
US-20240024306-A1 PROCESSES FOR PREPARING ARIMOCLOMOL CITRATE AND INTERMEDIATES THEREOF ACLY, AURKC, AURKA HSF1 4634/4885CYP2D6 1564/4885TSHR 4655/4885

“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.