SCHEMBL5586793

SCHEMBL5586793

C[C@H](Cc1ccccc1CC(=O)O)NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 13/20 0.49
CTSS P25774 12/20 0.49
CTSL P07711 3/20 0.48
CTSB P07858 3/20 0.48
ATM Q13315 1/20 0.47
ACE P12821 1/20 0.44
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
AKR1B1 P15121 1/20 0.42
AKT1 P31749 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
SCHEMBL2953753 0.84 ATM (0.47) CTSKCTSSCTSLCTSBATM
SCHEMBL12203694 0.81 NPC1 (0.63) CTSKCTSSCTSLCTSBATM
SCHEMBL29401299 0.81 NPC1 (0.63) CTSKCTSSCTSLCTSBATM
SCHEMBL3676166 0.81 NPC1 (0.63) CTSKCTSSCTSLCTSBATM
SCHEMBL3676162 0.81 NPC1 (0.63) CTSKCTSSCTSLCTSBATM
SCHEMBL5586794 0.81 ATM (0.49) CTSKCTSSCTSLCTSBATM
SCHEMBL4276615 0.79 CTSS (0.49) CTSKCTSSCTSLCTSBATM
SCHEMBL3621416 0.79 CTSS (0.49) CTSKCTSSCTSLCTSBATM
Dimethylamine SCHEMBL1435916 0.79 ATM (0.60) CTSKCTSSCTSLCTSBATM
SCHEMBL825511 0.77 KCNA5 (0.53) CTSKCTSSATMAKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241810-B2 Formamide derivatives for the treatment of diseases PFIZER INC (US) 2007-07-10 US disclosed
US-20050215590-A1 Formamide derivatives for the treatment of diseases PFIZER LIMITED (GB) 2005-09-29 US 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-20050215590-A1 Formamide derivatives for the treatment of diseases FH, FAH, HRH4 CTSK 1325/4885CTSS 823/4885CTSL 2318/4885

“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.