SCHEMBL24072201

SCHEMBL24072201

CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)O)C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.50
NR2F2 P24468 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
ALDH1A1 P00352 5/20 0.43
LMNA P02545 2/20 0.43
NPY2R P49146 1/20 0.43
MAPT P10636 1/20 0.43
ATM Q13315 1/20 0.42
HSD11B1 P28845 2/20 0.42
TGM2 P21980 2/20 0.41
ADAM17 P78536 1/20 0.40
F13A1 P00488 1/20 0.40
TGM1 P22735 1/20 0.40

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
SCHEMBL26673612 0.85 ALDH1A1 (0.52) ALDH1A1HSD11B1
SCHEMBL4035476 0.84 HSD11B1 (0.59) KMT2AMEN1MAOAALDH1A1LMNA
SCHEMBL6728595 0.77 F10 (0.49)
SCHEMBL3771947 0.77 STS (0.50) KMT2AMEN1ALDH1A1
SCHEMBL24072164 0.77 RAB9A (0.58) NPC1NR2F2RAB9AKMT2AMEN1
SCHEMBL24072645 0.76 RAB9A (0.60) NPC1NR2F2RAB9AKMT2AMEN1
SCHEMBL26673650 0.76 NR1H2 (0.61) KMT2AALDH1A1
SCHEMBL24072648 0.76 RAB9A (0.77) NPC1NR2F2RAB9AKMT2AMEN1
SCHEMBL24071820 0.75 NPC1 (0.64) NPC1NR2F2RAB9AKMT2AMEN1
SCHEMBL18064023 0.74 NR1H2 (0.54) KMT2AALDH1A1LMNAHSD11B1TGM2

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 4 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
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 NPC1 1157/4885NR2F2 2589/4885RAB9A 839/4885

“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.