SCHEMBL4569995

SCHEMBL4569995

CC(C)(C)OC(=O)N1CCCC(NC(=O)OCc2ccccc2)(C(=O)O)C1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.51
CTSL P07711 5/20 0.51
CTSB P07858 3/20 0.51
CTSK P43235 4/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
BACE1 P56817 1/20 0.42
P2RX7 Q99572 5/20 0.41
USP30 Q70CQ3 1/20 0.41
STS P08842 1/20 0.41

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
SCHEMBL29080198 0.92 CTSL (0.46) CTSSCTSLCTSBCTSKMEN1
SCHEMBL4569994 0.91 CTSS (0.51) CTSSCTSLCTSBCTSKMEN1
SCHEMBL17082042 0.91 CTSS (0.51) CTSSCTSLCTSBCTSKMEN1
SCHEMBL22041814 0.89 CTSB (0.48) CTSSCTSLCTSBCTSKMEN1
SCHEMBL2206561 0.87 MEN1 (0.47) CTSSCTSLCTSBMEN1KMT2A
SCHEMBL14638218 0.87 MEN1 (0.43) CTSSCTSLCTSBMEN1KMT2A
SCHEMBL14650130 0.87 MEN1 (0.43) CTSSCTSLCTSBMEN1KMT2A
SCHEMBL30922877 0.86 CTSL (0.44) CTSSCTSLCTSBMEN1KMT2A
SCHEMBL28412808 0.86 JAK2 (0.44) CTSSCTSLCTSBMEN1KMT2A
SCHEMBL30923062 0.86 CTSL (0.44) CTSSCTSLCTSBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812005-B1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2015-09-16 EP disclosed
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-05-17 US disclosed
US-8110581-B2 Lactam compounds and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-02-07 US disclosed
US-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2009-11-26 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 (2 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-20090291946-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 CTSS 3039/4885CTSL 3689/4885CTSB 2846/4885
US-20120122858-A1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS HSD11B1, HSD11B2, HSD17B1 CTSS 3039/4885CTSL 3689/4885CTSB 2846/4885

“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.