SCHEMBL1908238

SCHEMBL1908238

Cn1cnc2oc(-c3ccc(C4(NC(=O)OC(C)(C)C)CCC4)cc3)c(-c3ccccc3)c2c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.43
AKT2 P31751 1/20 0.43
LCK P06239 3/20 0.39
TNK2 Q07912 3/20 0.39
KIT P10721 1/20 0.37
LMNA P02545 2/20 0.36
THRB P10828 1/20 0.36
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 3/20 0.36
HPGD P15428 2/20 0.36
EGFR P00533 2/20 0.36
MAPT P10636 2/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
SYK P43405 3/20 0.36
KDR P35968 2/20 0.36
JAK2 O60674 1/20 0.36
SRC P12931 1/20 0.36
ZAP70 P43403 1/20 0.36
JAK3 P52333 1/20 0.36

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
SCHEMBL14118898 0.90 AKT1 (0.40) AKT1AKT2LCKTNK2KIT
SCHEMBL14118794 0.89 ALDH1A1 (0.41) LCKTNK2LMNATHRBALDH1A1
SCHEMBL1900418 0.89 AKT1 (0.41) AKT1AKT2LCKTNK2KIT
SCHEMBL14118922 0.89 AKT1 (0.41) AKT1AKT2LCKTNK2KIT
SCHEMBL14118951 0.89 AKT1 (0.40) AKT1AKT2LCKTNK2KIT
SCHEMBL1900913 0.88 AKT1 (0.41) AKT1AKT2LCKTNK2KIT
SCHEMBL14119341 0.87 AKT1 (0.40) AKT1AKT2LCKTNK2KIT
SCHEMBL14119078 0.86 AKT1 (0.40) AKT1AKT2LCKTNK2KIT
SCHEMBL1906905 0.86 AKT1 (0.40) AKT1AKT2LCKTNK2KIT
SCHEMBL14118561 0.86 AKT1 (0.44) AKT1AKT2LCKTNK2KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120309739-A1 AKT / PKB INHIBITORS ALMAC DISCOVERY LIMITED (GB) 2012-12-06 US disclosed
EP-2496566-A1 AKT / PKB INHIBITORS Almac Discovery Limited (GB) 2012-09-12 EP disclosed
WO-2011055115-A1 AKT / PKB INHIBITORS ALMAC DISCOVERY LIMITED (GB) 2011-05-12 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-20120309739-A1 AKT / PKB INHIBITORS AKT1, AKT2, AKT3 AKT1 1/4885AKT2 2/4885LCK 428/4885

“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.