SCHEMBL19964243

SCHEMBL19964243

Cc1ccc2c(cnn2COCCS(C)(C)C)c1Br

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL19616675 0.83 DGAT1 (0.37)
SCHEMBL17553324 0.81 GRM2 (0.32)
SCHEMBL22586970 0.79
SCHEMBL22708204 0.74 CHRM2 (0.38)
SCHEMBL25131157 0.73 CYP17A1 (0.40)
SCHEMBL19966632 0.70
SCHEMBL23660727 0.69 GLS (0.33)
SCHEMBL25021669 0.69 NPC1 (0.34)
SCHEMBL25368727 0.69 DGAT1 (0.41)
SCHEMBL29493823 0.69 DGAT1 (0.41)

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 11 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-11267812-B2 KRAS G12C inhibitors Mirati Therapeutics, Inc. (US) 2022-03-08 US disclosed
US-20210230170-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2021-07-29 US disclosed
US-20200308170-A1 KRAS G12C INHIBITORS ARRAY BIOPHARMA INC. 2020-10-01 US 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-10647715-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2020-05-12 US disclosed
US-10633381-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2020-04-28 US disclosed
US-20190270743-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2019-09-05 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