SCHEMBL14436617

SCHEMBL14436617

CC(C)(C)OC(=O)NC(CCC=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.50
CTSS P25774 5/20 0.50
MAPT P10636 1/20 0.50
ATM Q13315 1/20 0.47
GABRB1 P18505 1/20 0.45
GABRB2 P47870 1/20 0.45
PPARA Q07869 2/20 0.44
RIPK1 Q13546 1/20 0.44
PPARG P37231 1/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43

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
SCHEMBL24876971 0.91 CTSK (0.47) CTSKCTSSMAPTATMPPARA
SCHEMBL16565003 0.87 NPC1 (0.44) CTSKCTSSMAPTATM
SCHEMBL29465735 0.86 CTSK (0.52) CTSKCTSSMAPTATMGABRB1
SCHEMBL5460811 0.86 CTSK (0.52) CTSKCTSSMAPTATMGABRB1
SCHEMBL717324 0.86 CTSK (0.52) CTSKCTSSMAPTATMGABRB1
SCHEMBL1784108 0.86 CTSK (0.52) CTSKCTSSMAPTATMGABRB1
SCHEMBL4583120 0.85 CTSK (0.53) CTSKCTSSMAPTATMGABRB1
SCHEMBL28464584 0.85 CTSK (0.53) CTSKCTSSMAPTATMGABRB1
SCHEMBL56596 0.85 CTSK (0.53) CTSKCTSSMAPTATMGABRB1
SCHEMBL56698 0.85 CTSK (0.53) CTSKCTSSMAPTATMGABRB1

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
WO-2023283639-A1 EPITHELIAL SODIUM CHANNEL (ENAC) INHIBITOR CONJUGATES AND METHODS FOR USE THEREOF LUNG THERAPEUTICS, INC. (US) 2023-01-12 WO disclosed
US-20070191406-A1 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC 2007-08-16 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-20070191406-A1 Heterocyclic antiviral compounds CCR5, CX3CR1, CXCR1 CTSK 3111/4885CTSS 3002/4885MAPT 4306/4885

“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.