SCHEMBL30867692

SCHEMBL30867692

COC1(c2nccc(C)c2C2=CCN(C(=O)OC(C)(C)C)CC2)COC1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 10/20 0.45
GRM5 P41594 10/20 0.45
PDK4 Q16654 1/20 0.45
TNK2 Q07912 2/20 0.42
CCNT1 O60563 1/20 0.42
CDK9 P50750 1/20 0.42
WNT3A P56704 1/20 0.41
NAMPT P43490 1/20 0.40
CNR1 P21554 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
SCHEMBL31283409 0.89 GRM1 (0.46) GRM1GRM5PDK4TNK2CCNT1
SCHEMBL31282887 0.85 GRM1 (0.44) GRM1GRM5PDK4TNK2CCNT1
SCHEMBL30867776 0.82 CHRNA7 (0.31) GRM1GRM5PDK4
SCHEMBL31283106 0.82 GRM1 (0.49) GRM1GRM5PDK4TNK2CCNT1
SCHEMBL30867684 0.81 MAP4K4 (0.33)
SCHEMBL31703329 0.77 PDK4 (0.51) GRM1GRM5PDK4TNK2CCNT1
SCHEMBL30867920 0.76 GPR119 (0.43) WNT3A
SCHEMBL30867713 0.76 MAP4K4 (0.31)
SCHEMBL15024195 0.73 GRM1 (0.60) GRM1GRM5PDK4TNK2CCNT1
SCHEMBL18755022 0.72 PDK4 (0.53) GRM1GRM5PDK4TNK2NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4598916-A1 HETEROCYCLIC INHIBITORS OF KRAS G12C MUTANT PROTEINS AND USES THEREOF Amgen Inc. (US) 2025-08-13 EP disclosed
EP-4598917-A1 HETEROCYCLIC INHIBITORS OF KRAS G12C MUTANT PROTEINS AND USES THEREOF Amgen Inc. (US) 2025-08-13 EP disclosed
WO-2024076674-A1 HETEROCYCLIC INHIBITORS OF KRAS G12C MUTANT PROTEINS AND USES THEREOF AMGEN INC. (US) 2024-04-11 WO disclosed
WO-2024076672-A1 HETEROCYCLIC INHIBITORS OF KRAS G12C MUTANT PROTEINS AND USES THEREOF AMGEN INC. (US) 2024-04-11 WO disclosed