SCHEMBL1908498

SCHEMBL1908498

CC(C)(C)N(C(=O)OC(N)=O)C1(c2ccc(-c3oc4cc(C(N)=O)ccc4c3-c3ccccc3)cc2)CCC1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IP6K1 Q92551 1/20 0.35
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
AKT1 P31749 8/20 0.32
AKT2 P31751 5/20 0.32
RXFP1 Q9HBX9 1/20 0.32
RAB9A P51151 1/20 0.31
ACHE P22303 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
Carbamic Acid SCHEMBL1908497 0.90 IP6K1 (0.37) IP6K1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1901016 0.78 AKT1 (0.51) IP6K1AKT1AKT2
SCHEMBL1903074 0.77 MAPT (0.36) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL14118761 0.75 IP6K1 (0.41) IP6K1ALDH1A1TSHRAKT1AKT2
SCHEMBL1907828 0.73 AKT1 (0.37) AKT1
SCHEMBL1534347 0.72 AKT1 (0.48) IP6K1AKT1AKT2
SCHEMBL1534437 0.72 AKT1 (0.41) IP6K1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1901170 0.71 IP6K1 (0.43) IP6K1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1898953 0.71 AKT1 (0.37) KDM4EALDH1A1HSD17B10AKT1
SCHEMBL1904736 0.70 AKT1 (0.51) IP6K1AKT1AKT2RAB9A

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 IP6K1 138/4885KDM4E 2856/4885ALDH1A1 4803/4885

“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.