SCHEMBL6044100

SCHEMBL6044100

C[C@@H](CNC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HTT P42858 1/20 0.54
CTSK P43235 3/20 0.52
CTSS P25774 3/20 0.52
CTSL P07711 2/20 0.52
SYK P43405 1/20 0.52
CTSB P07858 1/20 0.52
ATM Q13315 1/20 0.51
SLC1A3 P43003 1/20 0.51
SLC1A1 P43005 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 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
SCHEMBL3840710 1.00 LMNA (0.56) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL6044097 1.00 LMNA (0.56) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL6045375 0.89 LMNA (0.55) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL6045379 0.89 LMNA (0.55) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL6045377 0.89 LMNA (0.55) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL13074240 0.88 LMNA (0.43) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL14350818 0.88 LMNA (0.43) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL7113323 0.88 LMNA (0.54) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL9293928 0.87 LMNA (0.59) LMNASMN1; SMN2HTTCTSKCTSS
SCHEMBL14590987 0.87 KMT2A (0.53) LMNASMN1; SMN2HTTCTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060154926-A1 Methods of treating alzheimer's disease using aryl alkanoic acid amides ELAN PHARMACEUTICALS, INC. 2006-07-13 US disclosed
US-5705658-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1998-01-06 US disclosed
US-5654445-A INTERMEDIATES FOR RENIN INHIBITORS, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-08-05 US disclosed
US-5646143-A FOR TREATING A VARIETY OF CONDITIONS CIBA-GEIGY CORPORATION (US) 1997-07-08 US disclosed
US-5627182-A RENIN INHIBITORS FOR USE AS HYPOTENSIVE AGENTS CIBA GEIGY CORPORATION (US) 1997-05-06 US disclosed
US-5559111-A HYPOTENSIVE AGENTS; RENIN INHIBITORS; Aliskiren CIBA-GEIGY CORPORATION (US) 1996-09-24 US disclosed
EP-0159708-A2 Chartreusin derivatives, salts thereof, antitumorous compositions containing the same, and processes for produing the same ISHIHARA SANGYO KAISHA, LTD. (JP) 1985-10-30 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-20060154926-A1 Methods of treating alzheimer's disease using aryl alkanoic acid amides BACE1, APP, PSEN1 LMNA 2080/4885SMN1; SMN2 1203/4885HTT 133/4885

“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.