SCHEMBL1901495

SCHEMBL1901495

CC(C)(C)OC(=O)NC1(c2ccc(-c3oc4c(=O)n(CCF)ccc4c3-c3ccccc3)cc2)CCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.40
AKT2 P31751 1/20 0.40
KIT P10721 2/20 0.35
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.33
PDE2A O00408 3/20 0.32
CYP3A4 P08684 2/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP2C9 P11712 1/20 0.32
HSD11B1 P28845 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CHRM2 P08172 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL14119201 0.89 PDE2A (0.33) AKT1PDE2ACYP3A4KMT2ACYP2C9
SCHEMBL1534537 0.89 AKT1 (0.39) AKT1AKT2KITCNR2CNR1
SCHEMBL1534573 0.88 AKT1 (0.40) AKT1AKT2KITCNR2CNR1
SCHEMBL1534577 0.84 AKT1 (0.41) AKT1AKT2KITCNR2CNR1
SCHEMBL14118951 0.82 AKT1 (0.40) AKT1AKT2KITCNR2CNR1
SCHEMBL1903477 0.81 TACR3 (0.32) PDE2ACYP3A4KMT2ACYP2C9CYP2C19
SCHEMBL1906606 0.80 AKT1 (0.41) AKT1AKT2KITCNR2CNR1
SCHEMBL14119236 0.79 AKT1 (0.40) AKT1AKT2KITCNR2CNR1
SCHEMBL1906138 0.79 AKT1 (0.43) AKT1AKT2
SCHEMBL12095316 0.78 TACR3 (0.35) AKT1AKT2PDE2ACYP3A4KDM4E

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 2/4885KIT 1541/4885

“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.