SCHEMBL6448464

SCHEMBL6448464

CC(C)[C@H](NC(=O)CN1CCOCC1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 5/20 0.49
ELANE P08246 2/20 0.47
HSD17B10 Q99714 2/20 0.47
LMNA P02545 1/20 0.47
KDM4E B2RXH2 4/20 0.44
USP2 O75604 1/20 0.44
HTT P42858 1/20 0.44
CHRM5 P08912 1/20 0.44
CHRM3 P20309 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 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
SCHEMBL6448460 1.00 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1ELANEHSD17B10LMNA
SCHEMBL6442998 0.85 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1HSD17B10LMNATSHR
SCHEMBL6442995 0.85 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1HSD17B10LMNATSHR
SCHEMBL16118687 0.84 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1HSD17B10LMNAKDM4E
SCHEMBL16228134 0.84 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1HSD17B10LMNAKDM4E
SCHEMBL7720951 0.82 CHRM5 (0.64) SMN1; SMN2ALDH1A1HSD17B10LMNAKDM4E
SCHEMBL15569026 0.79 PSMB10 (0.51) SMN1; SMN2ALDH1A1LMNA
SCHEMBL15569025 0.79 PSMB10 (0.51) SMN1; SMN2ALDH1A1LMNA
SCHEMBL25083196 0.79 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1HSD17B10LMNAKDM4E
SCHEMBL15066425 0.79 HSD17B10 (0.56) SMN1; SMN2ALDH1A1HSD17B10LMNAKDM4E

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 SMN1; SMN2 1200/4885ALDH1A1 889/4885ELANE 446/4885

“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.