SCHEMBL840145

SCHEMBL840145

Cc1ncccc1N(NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.37
AKT1 P31749 3/20 0.37
RAB9A P51151 3/20 0.36
ATR Q13535 1/20 0.36
HSD17B1 P14061 1/20 0.36
P2RX7 Q99572 1/20 0.35
NAMPT P43490 1/20 0.35
CTSL P07711 2/20 0.34
CTSB P07858 2/20 0.34
CTSS P25774 2/20 0.34
STS P08842 1/20 0.34
NPC1 O15118 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LCK P06239 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL10272238 0.88 ATR (0.35) METAP1AKT1RAB9AATRHSD17B1
SCHEMBL21598464 0.85 ATR (0.38) METAP1AKT1RAB9AATRNAMPT
SCHEMBL24672991 0.79 HSD17B1 (0.44) METAP1HSD17B1P2RX7STSL3MBTL1
SCHEMBL30668738 0.79 HSD17B1 (0.44) METAP1HSD17B1P2RX7STSL3MBTL1
SCHEMBL20265462 0.79 KDM4E (0.45) AKT1RAB9AATRNPC1KMT2A
SCHEMBL1781991 0.78 POLB (0.43) METAP1AKT1RAB9AATRCTSL
SCHEMBL14108092 0.78 AKT1 (0.39) AKT1CTSLCTSBCTSSKMT2A
SCHEMBL28554070 0.77 SLC13A5 (0.39) GAA
SCHEMBL838521 0.76 RAB9A (0.39) AKT1RAB9AATRHSD17B1NAMPT
SCHEMBL10563210 0.75 LMNA (0.52) AKT1CTSLCTSBCTSSKMT2A

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-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
EP-2324028-A2 THERAPEUTIC AGENTS 414 AstraZeneca AB (SE) 2011-05-25 EP disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
WO-2010015849-A2 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-02-11 WO disclosed
WO-2010015849-A2 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-02-11 WO 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-20100093757-A1 THERAPEUTIC AGENTS 414 GCK, GCKR, GPR119 METAP1 1303/4885AKT1 1306/4885RAB9A 3239/4885

“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.