SCHEMBL30998654

SCHEMBL30998654

CC(C)(C)OC(=O)N1CC2CC[C@H]1CN2Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 4/20 0.53
KCNK9 Q9NPC2 4/20 0.53
SIGMAR1 Q99720 1/20 0.48
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL29344027 1.00 KCNK3 (0.53) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL1365607 0.90 HSD11B1 (0.48) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL18112122 0.90 HSD11B1 (0.48) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL8013274 0.90 HSD11B1 (0.48) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL928364 0.90 HSD11B1 (0.48) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL24649336 0.86 KCNK3 (0.43) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL30695227 0.86 KCNK3 (0.43) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL24649043 0.84 KMT2A (0.42) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL27044069 0.84 KMT2A (0.42) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1
SCHEMBL24649349 0.84 KMT2A (0.42) KCNK3KCNK9SIGMAR1KMT2AL3MBTL1

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-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-18 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-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT KRAS, NRAS, HRAS KCNK3 3840/4885KCNK9 3730/4885SIGMAR1 4769/4885

“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.