SCHEMBL6444986

SCHEMBL6444986

O=[C]CCCCNC(=O)OCc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.67
KEAP1 Q14145 3/20 0.64
NFE2L2 Q16236 3/20 0.64
TGM2 P21980 1/20 0.63
LMNA P02545 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
FOLH1 Q04609 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
DPP8 Q6V1X1 1/20 0.51
DPP7 Q9UHL4 1/20 0.51
MAPT P10636 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50

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
SCHEMBL7285301 0.99 TGM2 (0.65) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL7283930 0.99 TGM2 (0.65) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL3151115 0.99 TGM2 (0.65) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL7283534 0.99 TGM2 (0.65) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL7283765 0.99 TGM2 (0.65) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL9222029 0.99 TGM2 (0.65) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL3724360 0.95 HTT (0.68) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL6539554 0.89 LMNA (0.67) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL18254066 0.89 HTT (0.81) HTTKEAP1NFE2L2TGM2LMNA
SCHEMBL9874334 0.88 HTT (0.79) HTTKEAP1NFE2L2TGM2LMNA

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 8 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-0604368-B1 Anti retroviral hydrazine derivatives CIBA GEIGY AG (CH) 1996-09-18 EP disclosed
EP-0604368-A1 Anti retroviral hydrazine derivatives CIBA-GEIGY AG (CH) 1994-06-29 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 HTT 55/4885KEAP1 1291/4885NFE2L2 1413/4885

“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.