SCHEMBL13636269

SCHEMBL13636269

CC(C)(C)OC(=O)NN(C=O)c1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.44
CTSL P07711 2/20 0.38
CTSB P07858 2/20 0.38
CTSS P25774 2/20 0.38
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
MAPK10 P53779 1/20 0.36
BCL2A1 Q16548 1/20 0.36
LCK P06239 1/20 0.36
ATR Q13535 1/20 0.35
EPHX2 P34913 1/20 0.35
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
CA7 P43166 1/20 0.35

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
SCHEMBL13636272 0.83 AKT1 (0.41) AKT1CTSLCTSBCTSSCA12
SCHEMBL13635931 0.82 AKT1 (0.36) AKT1CA12CA1CA2CA9
SCHEMBL38663993 0.72 LCK (0.46) CA12CA1CA2CA9LCK
SCHEMBL4376494 0.71 AKT1 (0.43) AKT1CTSLCTSBCTSSCA12
SCHEMBL6233792 0.70 AKT1 (0.44) AKT1CTSLCTSBCTSSCA12
SCHEMBL291831 0.69 AKT1 (0.46) AKT1CTSLCTSBCTSSCA12
SCHEMBL5769720 0.69 CKS1B (0.43) LMNAMEN1NPC1GAARAB9A
SCHEMBL4331971 0.69 CTSK (0.36) BCL2A1LMNAMEN1NPC1KMT2A
SCHEMBL4331969 0.69 CTSK (0.36) BCL2A1LMNAMEN1NPC1KMT2A
SCHEMBL4413477 0.69 AKT1 (0.40) AKT1CTSLCTSBCTSSCA12

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-7622492-B2 Pyrazolones as inhibitors of 11β-hydroxysteroid dehydrogenase HOFFMANN-LA ROCHE INC. (US) 2009-11-24 US disclosed
US-20070049632-A1 Pyrazolones as inhibitors of 11B-hydroxysteroid dehydrogenase BANNER BRUCE L 2007-03-01 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-20070049632-A1 Pyrazolones as inhibitors of 11B-hydroxysteroid dehydrogenase HSD17B1, HSD17B2, HSD3B2 AKT1 1050/4885CTSL 4503/4885CTSB 3768/4885

“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.