SCHEMBL19948150

SCHEMBL19948150

CC1c2nc(Cl)nc(N3CCN(C(=O)O)C(C(C)(C)C)C3)c2CCN1Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 1/20 0.37
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
GRM2 Q14416 2/20 0.34
CHRM4 P08173 10/20 0.33
CHRM2 P08172 3/20 0.33
CHRM1 P11229 2/20 0.33
LIMK2 P53671 1/20 0.33
IDH1 O75874 1/20 0.32

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
SCHEMBL19617700 0.86 CFTR (0.36) GRM2CHRM4
SCHEMBL19948975 0.84 KRAS (0.38) SLC6A7PDK1PDK2PDK3PDK4
SCHEMBL19947816 0.81 C5AR1 (0.44) GRM2
SCHEMBL19616976 0.80 ACHE (0.44)
SCHEMBL19948152 0.80 ACHE (0.44)
SCHEMBL28905734 0.77 BRS3 (0.43)
SCHEMBL30675362 0.75 OPRD1 (0.42) CHRM4
SCHEMBL19616868 0.74 MAPT (0.40)
SCHEMBL3773661 0.69 AGTR2 (0.50)
SCHEMBL6337270 0.69 SLC6A7 (0.43) SLC6A7CHRM4CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240101553-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2024-03-28 US disclosed
EP-3710439-B1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-02-15 EP disclosed
US-11267812-B2 KRAS G12C inhibitors Mirati Therapeutics, Inc. (US) 2022-03-08 US disclosed
EP-3458445-B1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2021-02-17 EP disclosed
US-20200262837-A1 KRAS G12C INHIBITORS ARRAY BIOPHARMA INC. 2020-08-20 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-10125134-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2018-11-13 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 (8 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 SLC6A7 2513/4885PDK1 981/4885PDK2 2683/4885
US-10633381-B2 KRas G12C inhibitors KRAS, NRAS, HRAS SLC6A7 2513/4885PDK1 981/4885PDK2 2683/4885
US-20200262837-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS SLC6A7 2513/4885PDK1 981/4885PDK2 2683/4885
US-11267812-B2 KRAS G12C inhibitors KRAS, NRAS, HRAS SLC6A7 2513/4885PDK1 981/4885PDK2 2683/4885
US-10125134-B2 KRas G12C inhibitors KRAS, NRAS, HRAS SLC6A7 2513/4885PDK1 981/4885PDK2 2683/4885
US-10689377-B2 KRas G12C inhibitors KRAS, NRAS, HRAS SLC6A7 2513/4885PDK1 981/4885PDK2 2683/4885
US-20240101553-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS SLC6A7 2513/4885PDK1 981/4885PDK2 2683/4885
US-20180072723-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS SLC6A7 2513/4885PDK1 981/4885PDK2 2683/4885

“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.