SCHEMBL20334362

SCHEMBL20334362

CC(C)N1CCN(C)CC1CCO

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.50
POLB P06746 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 4/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
RECQL P46063 2/20 0.43
MAPK1 P28482 3/20 0.42
GAA P10253 2/20 0.42
ALDH1A1 P00352 5/20 0.42
SIGMAR1 Q99720 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL16158844 0.85 PKM (0.36) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL16158903 0.85 PKM (0.36) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL16158945 0.85 PKM (0.36) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL25840836 0.83 PKM (0.35) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL25738599 0.81 PKM (0.35) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL20314954 0.81 PKM (0.50) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL24759099 0.79 PKM (0.58) PKMPOLBL3MBTL1LMNAKMT2A
SCHEMBL12828284 0.79 PKM (0.31) PKM
SCHEMBL24091521 0.79 PKM (0.31) PKM
SCHEMBL25737735 0.79 NCF1 (0.40) PKM

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
EP-4001269-A1 BENZOISOTHIAZOLE, ISOTHIAZOLO[3,4-B]PYRIDINE, QUINAZOLINE, PHTHALAZINE, PYRIDO[2,3-D]PYRIDAZINE AND PYRIDO[2,3-D]PYRIMIDINE DERIVATIVES AS KRAS G12C INHIBITORS FOR TREATING LUNG, PANCREATIC OR COLORECTAL CANCER Amgen Inc. (US) 2022-05-25 EP disclosed
US-11285135-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2022-03-29 US disclosed
EP-3558955-B1 BENZISOTHIAZOLE, ISOTHIAZOLO[3,4-B]PYRIDINE, QUINAZOLINE, PHTHALAZINE, PYRIDO[2,3-D]PYRIDAZINE AND PYRIDO[2,3-D]PYRIMIDINE DERIVATIVES AS KRAS G12C INHIBITORS FOR TREATING LUNG, PANCREATIC OR COLORECTAL CANCER AMGEN INC (US) 2021-08-11 EP disclosed
US-20200069657-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. (US) 2020-03-05 US disclosed
WO-2018119183-A2 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. (US) 2018-06-28 WO 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-20200069657-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS PKM 4506/4885POLB 742/4885L3MBTL1 3340/4885
US-11285135-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, HRAS PKM 4005/4885POLB 573/4885L3MBTL1 4185/4885

“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.