SCHEMBL19964258

SCHEMBL19964258

CCCC[C@H]1CN2C(=O)OC[C@H]2CN1C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.38
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PDE4B Q07343 3/20 0.35
PDE4D Q08499 1/20 0.35
HSD11B1 P28845 1/20 0.34
MAN2B1 O00754 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
GRM2 Q14416 1/20 0.32
AR P10275 1/20 0.31
SRC P12931 4/20 0.31
PARP1 P09874 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
SCHEMBL30895351 0.80 GPR119 (0.39) PDE4BHSD11B1GRM2ARPARP1
SCHEMBL19959353 0.80 GPR119 (0.39) PDE4BHSD11B1GRM2ARPARP1
SCHEMBL14117916 0.72 ATM (0.45) ATMALDH1A1KMT2A
SCHEMBL780002 0.70 USP30 (0.43) ALDH1A1MEN1KMT2A
SCHEMBL2954128 0.70 USP30 (0.43) ALDH1A1MEN1KMT2A
SCHEMBL2943987 0.70 USP30 (0.43) ALDH1A1MEN1KMT2A
SCHEMBL15304847 0.70 MEN1 (0.41) ATMALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL15344697 0.70 MEN1 (0.41) ATMALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL9965481 0.69 ATM (0.45) ATMALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL642245 0.69 ATM (0.45) ATMALDH1A1MEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180072723-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2018-03-15 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 (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-20180072723-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS ATM 3528/4885ALDH1A1 3370/4885MEN1 348/4885

“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.