SCHEMBL24705709

SCHEMBL24705709

CC(C)(C)OC(O)Nc1cn(Cc2ccccc2)nc1C1CC1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 7/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SCD O00767 3/20 0.36
GAA P10253 1/20 0.35
ATM Q13315 1/20 0.35
CYP19A1 P11511 1/20 0.34
RIPK1 Q13546 2/20 0.34
SCD5 Q86SK9 1/20 0.33
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
AADAT Q8N5Z0 2/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL21567564 0.79 KMT2A (0.47) KMT2AL3MBTL1SCDGAAATM
SCHEMBL21543340 0.75 SCD (0.45) KLKB1SCDGAACYP19A1SCD5
SCHEMBL21542778 0.73 ALDH1A1 (0.42) KLKB1KMT2ASCDRIPK1SCD5
SCHEMBL25678892 0.71 NPC1 (0.47) KLKB1CYP19A1ALDH1A1MAPTAADAT
SCHEMBL21543007 0.69 CYP19A1 (0.44) KLKB1L3MBTL1CYP19A1ALDH1A1MAPT
SCHEMBL25680697 0.69 CYP19A1 (0.44) KLKB1L3MBTL1SCDCYP19A1SCD5
SCHEMBL19775182 0.63 LMNA (0.35) KMT2AL3MBTL1GAAMEN1ALDH1A1
SCHEMBL16789558 0.63 TDP1 (0.45) KMT2AL3MBTL1GAAATMMEN1
SCHEMBL717194 0.61 CYP19A1 (0.43) KMT2ASCDCYP19A1MEN1ALDH1A1
SCHEMBL21561746 0.61 SIGMAR1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11766436-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2023-09-26 US disclosed
US-20220395504-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. 2022-12-15 US 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-20220395504-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS KLKB1 4275/4885KMT2A 2069/4885L3MBTL1 3825/4885
US-11766436-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, HRAS KLKB1 4275/4885KMT2A 2069/4885L3MBTL1 3825/4885

“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.