SCHEMBL19964291

SCHEMBL19964291

COCC[C@H]1CN(C)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.35
NR1H3 Q13133 2/20 0.35
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA4 P22748 2/20 0.34
CA9 Q16790 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 2/20 0.34
BACE1 P56817 2/20 0.34
CTSD P07339 1/20 0.34

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
SCHEMBL4836282 0.86 MEN1 (0.42) NR1H2SMN1; SMN2HSD17B10ALDH1A1MEN1
SCHEMBL19964293 0.86 CA1 (0.46) NR1H2SMN1; SMN2NR1H3CA1CA2
SCHEMBL22709903 0.86 NR1H2 (0.39) NR1H2SMN1; SMN2HSD17B10NR1H3
SCHEMBL4836292 0.84 HSD17B10 (0.39) NR1H2SMN1; SMN2HSD17B10NR1H3ALDH1A1
SCHEMBL2157015 0.82 NR1H2 (0.48) NR1H2SMN1; SMN2HSD17B10NR1H3MEN1
SCHEMBL2157059 0.82 NR1H2 (0.48) NR1H2SMN1; SMN2HSD17B10NR1H3MEN1
SCHEMBL2157021 0.82 NR1H2 (0.48) NR1H2SMN1; SMN2HSD17B10NR1H3MEN1
SCHEMBL26796816 0.81 HSD17B10 (0.46) SMN1; SMN2HSD17B10ALDH1A1MEN1KMT2A
SCHEMBL28019383 0.81 NR1H2 (0.40) NR1H2SMN1; SMN2HSD17B10NR1H3
SCHEMBL31757719 0.81 BRD4 (0.41) NR1H2SMN1; SMN2HSD17B10NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373999-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-11-23 US disclosed
US-10689377-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2020-06-23 US disclosed
US-10633381-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2020-04-28 US disclosed
US-20190144444-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2019-05-16 US disclosed
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 (5 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-20190144444-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS NR1H2 1539/4885SMN1; SMN2 4385/4885HSD17B10 3889/4885
US-10633381-B2 KRas G12C inhibitors KRAS, NRAS, HRAS NR1H2 1539/4885SMN1; SMN2 4385/4885HSD17B10 3889/4885
US-10689377-B2 KRas G12C inhibitors KRAS, NRAS, HRAS NR1H2 1539/4885SMN1; SMN2 4385/4885HSD17B10 3889/4885
US-20180072723-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS NR1H2 1539/4885SMN1; SMN2 4385/4885HSD17B10 3889/4885
US-20230373999-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS NR1H2 1539/4885SMN1; SMN2 4385/4885HSD17B10 3889/4885

“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.