SCHEMBL24072159

SCHEMBL24072159

CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Oc3ccc(S(=O)(=O)N(CC)CC)cc3)cc2)C1

nearest known ligand 0.90

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.90
NPC1 O15118 1/20 0.90
NR2F2 P24468 1/20 0.90
ALDH1A1 P00352 5/20 0.73
SMN1; SMN2 Q16637 3/20 0.68
CYP2C19 P33261 1/20 0.67
GAA P10253 1/20 0.63
TSHR P16473 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
TP53 P04637 1/20 0.54
PKM P14618 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL24072629 0.95 RAB9A (1.00) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL24072197 0.95 RAB9A (1.00) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL24072179 0.92 RAB9A (0.94) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL25282611 0.89 RAB9A (0.71) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL25287951 0.89 RAB9A (0.71) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL24072655 0.89 RAB9A (0.84) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL24072637 0.89 RAB9A (0.88) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL24072634 0.89 RAB9A (0.88) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL24071815 0.88 RAB9A (0.83) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2
SCHEMBL30292770 0.88 RAB9A (0.83) RAB9ANPC1NR2F2ALDH1A1SMN1; SMN2

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 5 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
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
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
WO-2021242753-A1 MITOCHONDRIAL TARGETING COMPOUNDS FOR THE TREATMENT OF ASSOCIATED DISEASES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-12-02 WO 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 839/4885NPC1 1157/4885NR2F2 2589/4885

“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.