SCHEMBL6444689

SCHEMBL6444689

[CH2]C(CS(=O)(=O)NCc1ccccc1)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 3/20 0.50
▸ CA12 O43570 3/20 0.50
▸ CA7 P43166 2/20 0.50
▸ CA14 Q9ULX7 2/20 0.50
▸ CA1 P00915 2/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ KEAP1 Q14145 1/20 0.46
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HTT P42858 1/20 0.43
▸ OPRK1 P41145 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ KMT2A Q03164 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
SCHEMBL10317146 0.80 CA12 (0.53) CA2CA12CA7CA14CA1
SCHEMBL6444934 0.78 CA2 (0.47) CA2CA12CA7CA14CA1
SCHEMBL6444937 0.78 CA2 (0.47) CA2CA12CA7CA14CA1
SCHEMBL7279703 0.78 CA12 (0.47) CA2CA12CA7CA14CA1
SCHEMBL171653 0.75 CA2 (0.61) CA2CA12CA7CA14CA1
SCHEMBL2112943 0.75 CA2 (0.65) CA2CA12CA7CA14CA1
SCHEMBL21536760 0.73 CA2 (0.53) CA2CA12CA7CA14CA1
SCHEMBL5287971 0.73 CA12 (0.63) CA2CA12CA7CA14CA1
SCHEMBL7270211 0.73 CA12 (0.45) CA2CA12CA7CA14CA1
SCHEMBL16477917 0.73 CA12 (0.68) CA2CA12CA7CA14CA1

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 CA2 608/4885CA12 613/4885CA7 1535/4885

“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.

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