SCHEMBL6445955

SCHEMBL6445955

C[CH]c1ccc(NC(=O)OCc2ccccc2)cc1NC(=O)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.50
TP53 P04637 3/20 0.48
MAPT P10636 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
ATM Q13315 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
POLB P06746 1/20 0.46
ENPP2 Q13822 3/20 0.46
ROCK2 O75116 1/20 0.45
LMNA P02545 1/20 0.44
PTPN1 P18031 1/20 0.43
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
SCD O00767 2/20 0.43
BTK Q06187 1/20 0.42

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
SCHEMBL6443584 0.91 MGLL (0.56) MGLLTP53MAPTNPC1RAB9A
SCHEMBL6445958 0.82 NPC1 (0.51) MGLLTP53MAPTNPC1RAB9A
SCHEMBL27542348 0.77 NPC1 (0.67) MGLLTP53MAPTNPC1RAB9A
SCHEMBL10390065 0.75 POLB (0.54) MGLLTP53MAPTNPC1RAB9A
SCHEMBL11766069 0.74 NPC1 (0.72) MGLLTP53MAPTNPC1RAB9A
SCHEMBL28544012 0.74 MGLL (0.54) MGLLTP53MAPTNPC1RAB9A
SCHEMBL397072 0.74 MGLL (0.51) MGLLTP53MAPTNPC1RAB9A
SCHEMBL10390066 0.74 POLB (0.56) MGLLTP53MAPTNPC1RAB9A
SCHEMBL3792767 0.72 MGLL (0.61) MGLLTP53MAPTNPC1RAB9A
SCHEMBL7595080 0.72 MGLL (0.49) MGLLTP53MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050130941-A1 Methods of treating alzheimer's disease PHARMACIA & UPJOHN COMPANY LLC 2005-06-16 US disclosed
EP-1392315-A1 METHODS OF TREATING ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
WO-2002100410-A1 METHODS OF TREATING ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed
US-5753652-A Antiretroviral hydrazine derivatives NOVARTIS CORPORATION (US) 1998-05-19 US disclosed
EP-0521827-B1 Pharmacological active hydrazin derivatives and process for their preparation CIBA GEIGY AG (CH) 1996-09-25 EP disclosed
EP-0521827-A1 Pharmacological active hydrazin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-01-07 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-20050130941-A1 Methods of treating alzheimer's disease BACE1, PSEN1, BACE2 MGLL 1607/4885TP53 2638/4885MAPT 56/4885

“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.