SCHEMBL16122889

SCHEMBL16122889

CC(C)(C)OC(=O)N1CCN(C(=O)CNc2ccc(Cl)c3ccccc23)CC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DTYMK P23919 2/20 0.49
▸ CHRM2 P08172 1/20 0.49
▸ CHRM4 P08173 1/20 0.49
▸ CHRM1 P11229 1/20 0.49
▸ CHRM3 P20309 1/20 0.49
▸ POLB P06746 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ACHE P22303 2/20 0.42
▸ CCR8 P51685 1/20 0.42
▸ STS P08842 2/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ KDM1A O60341 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
SCHEMBL16117745 0.79 KRAS (0.57) KMT2AACHE
SCHEMBL4844156 0.78 GPR119 (0.55) DTYMKCHRM2CHRM4CHRM1CHRM3
SCHEMBL16098893 0.77 MEN1 (0.43) DTYMKCHRM2CHRM4CHRM1CHRM3
SCHEMBL15337783 0.77 KRAS (0.47) DTYMKCHRM2CHRM4CHRM1CHRM3
SCHEMBL16102324 0.76 GAA (0.44) POLBMEN1KMT2ASTSHTT
SCHEMBL24754834 0.74 DTYMK (0.43) DTYMKCHRM2CHRM4CHRM1CHRM3
SCHEMBL30029495 0.74 DTYMK (0.43) DTYMKCHRM2CHRM4CHRM1CHRM3
SCHEMBL30642270 0.73 KRAS (0.50) MEN1KMT2ASTS
SCHEMBL16122826 0.73 KRAS (0.50) MEN1KMT2ASTS
SCHEMBL5363084 0.72 STS (0.50) DTYMKCHRM2CHRM4CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3401314-B1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-11-08 — — EP disclosed
US-10919850-B2 Covalent inhibitors of KRas G12C ARAXES PHARMA LLC (US) 2021-02-16 — — US disclosed
US-10273207-B2 Covalent inhibitors of kras G12C ARAXES PHARMA LLC (US) 2019-04-30 — — US disclosed
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-06-14 — — US disclosed
US-9926267-B2 Covalent inhibitors of K-Ras G12C ARAXES PHARMA LLC (US) 2018-03-27 — — US disclosed
US-20160159738-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2016-06-09 — — US disclosed
US-9227978-B2 Covalent inhibitors of Kras G12C ARAXES PHARMA LLC (US) 2016-01-05 — — US disclosed
WO-2014152588-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2014-09-25 — — WO disclosed
US-20140288045-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2014-09-25 — — 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-20140288045-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS DTYMK 456/4885CHRM2 4806/4885CHRM4 4853/4885
US-20160159738-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS DTYMK 456/4885CHRM2 4806/4885CHRM4 4853/4885
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS DTYMK 456/4885CHRM2 4806/4885CHRM4 4853/4885
US-10919850-B2 Covalent inhibitors of KRas G12C KRAS, NRAS, HRAS DTYMK 456/4885CHRM2 4806/4885CHRM4 4853/4885
US-10273207-B2 Covalent inhibitors of kras G12C KRAS, NRAS, HRAS DTYMK 456/4885CHRM2 4806/4885CHRM4 4853/4885

“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.

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