SCHEMBL22396146

SCHEMBL22396146

CC(C)(C)OC(=O)NC1(c2cnn[nH]2)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.35
NR1H2 P55055 1/20 0.34
GAA P10253 2/20 0.33
KIT P10721 2/20 0.33
APLNR P35414 1/20 0.33
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
NAMPT P43490 1/20 0.32
TRPA1 O75762 1/20 0.31
MAPK10 P53779 1/20 0.31
KDM4E B2RXH2 1/20 0.31
P2RX7 Q99572 1/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
GFER P55789 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL29359692 0.75 CKS1B (0.41) GAANFKB1NFKB2RELAKMT2A
SCHEMBL34468939 0.73 AKT1 (0.40) AKT1NR1H2GAAKITNFKB1
SCHEMBL19920756 0.73 AKT1 (0.38) AKT1GAAKITAPLNRNFKB1
SCHEMBL18292853 0.72 VNN1 (0.40) AKT1
SCHEMBL2143233 0.72 AKT1 (0.41) AKT1KITAPLNRNAMPTTRPA1
SCHEMBL2392301 0.71 AKT1 (0.38) AKT1GAAKITNFKB1NFKB2
SCHEMBL9923449 0.71 AKT1 (0.47) AKT1KIT
SCHEMBL2392208 0.71 AKT1 (0.44) AKT1GAAKITNFKB1NFKB2
SCHEMBL29168026 0.70 AKT1 (0.38) AKT1GAAAPLNRLMNAALDH1A1
SCHEMBL22148596 0.70 KIT (0.39) AKT1KITNFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11267825-B2 Highly active amino-thiazole substituted indole-2-carboxamides active against the hepatitis B virus (HBV) AICURIS GMBH & CO. KG (DE) 2022-03-08 US disclosed
US-20200354379-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2020-11-12 US disclosed
EP-3704127-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AiCuris GmbH & Co. KG (DE) 2020-09-09 EP disclosed
CN-111448199-A Novel highly active amino-thiazole-substituted indole-2-carboxamides having activity against Hepatitis B Virus (HBV) 艾库里斯有限及两合公司 2020-07-24 CN 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 (2 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-20200354379-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) HCCS, CDK2, BRD4 AKT1 1188/4885NR1H2 1394/4885GAA 4368/4885
US-11267825-B2 Highly active amino-thiazole substituted indole-2-carboxamides active against the hepatitis B virus (HBV) HCCS, BRD4, IDO2 AKT1 1056/4885NR1H2 1188/4885GAA 4177/4885

“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.