SCHEMBL839554

SCHEMBL839554

COCC[C@H](OC(C)=O)C(=O)Nc1ccc(C)cn1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCK P35557 9/20 0.52
KCNH2 Q12809 4/20 0.50
RAB9A P51151 3/20 0.48
MAPT P10636 1/20 0.48
KLK7 P49862 1/20 0.46
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 2/20 0.43
MITF O75030 1/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
RXFP1 Q9HBX9 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
SCHEMBL839555 1.00 GCK (0.52) GCKKCNH2RAB9AMAPTKLK7
SCHEMBL839351 0.90 RAB9A (0.50) GCKKCNH2RAB9AMAPTKMT2A
SCHEMBL838342 0.82 RAB9A (0.53) GCKKCNH2RAB9AMAPTKMT2A
SCHEMBL838343 0.82 RAB9A (0.53) GCKKCNH2RAB9AMAPTKMT2A
SCHEMBL838748 0.77 RAB9A (0.55) GCKKCNH2RAB9AMAPTKMT2A
SCHEMBL839502 0.77 RAB9A (0.55) GCKKCNH2RAB9AMAPTKMT2A
SCHEMBL839591 0.77 RAB9A (0.55) GCKKCNH2RAB9AMAPTKMT2A
SCHEMBL839644 0.76 RAB9A (0.54) GCKKCNH2RAB9AMAPTKMT2A
SCHEMBL839668 0.75 RAB9A (0.47) GCKKCNH2RAB9AMAPTKMT2A
SCHEMBL839223 0.74 GCK (0.46) GCKKCNH2RAB9AMAPTKMT2A

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 9 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
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
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 GCK 1/4885KCNH2 1438/4885RAB9A 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.