SCHEMBL30292736

SCHEMBL30292736

CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(S(=O)(=O)Cl)cc2)C1

nearest known ligand 0.84

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.84
ALDH1A1 P00352 6/20 0.83
SMN1; SMN2 Q16637 3/20 0.79
CYP2C19 P33261 1/20 0.79
NPC1 O15118 1/20 0.74
NR2F2 P24468 1/20 0.74
GAA P10253 2/20 0.73
KMT2A Q03164 2/20 0.65
TSHR P16473 2/20 0.64
NPSR1 Q6W5P4 1/20 0.64
TP53 P04637 1/20 0.62

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
SCHEMBL5250351 0.91 RAB9A (0.84) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL15362323 0.91 ALDH1A1 (1.00) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL24072673 0.91 RAB9A (0.98) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL30292744 0.88 RAB9A (0.67) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL24072134 0.88 ALDH1A1 (1.00) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL24071842 0.88 RAB9A (0.84) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL612760 0.88 CYP2C19 (1.00) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL7534615 0.87 ALDH1A1 (1.00) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL24072215 0.86 RAB9A (0.85) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1
SCHEMBL24072211 0.86 RAB9A (0.82) RAB9AALDH1A1SMN1; SMN2CYP2C19NPC1

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-20230212122-A1 MITOCHONDRIAL TARGETING COMPOUNDS FOR THE TREATMENT OF ASSOCIATED DISEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-07-06 US disclosed
EP-4157263-A1 MITOCHONDRIAL TARGETING COMPOUNDS FOR THE TREATMENT OF ASSOCIATED DISEASES The Regents Of The University Of Michigan (US) 2023-04-05 EP 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-20230212122-A1 MITOCHONDRIAL TARGETING COMPOUNDS FOR THE TREATMENT OF ASSOCIATED DISEASES TFAM, CS, FH RAB9A 839/4885ALDH1A1 2339/4885SMN1; SMN2 646/4885

“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.