SCHEMBL31170592

SCHEMBL31170592

CC(C)(C)OC(=O)N1CCN(C(=O)n2ccnn2)CC1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
POLB P06746 1/20 0.44
HTT P42858 1/20 0.44
ATM Q13315 1/20 0.44
GPR119 Q8TDV5 6/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.39

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
SCHEMBL8136815 0.82 FAAH (0.36) USP2SMN1; SMN2POLBHTTATM
SCHEMBL17276537 0.81 POLB (0.49) USP2SMN1; SMN2POLBGPR119
SCHEMBL28323959 0.79 CYP1A2 (0.43) SMN1; SMN2MEN1KMT2AALDH1A1HPGD
SCHEMBL27388627 0.78 USP2 (0.62) USP2SMN1; SMN2POLBHTTATM
SCHEMBL17276687 0.77 POLB (0.46) USP2SMN1; SMN2POLBGPR119MEN1
SCHEMBL31169844 0.76 USP2 (0.49) USP2SMN1; SMN2POLBHTTATM
SCHEMBL31170642 0.76 GPR119 (0.44) USP2SMN1; SMN2POLBHTTATM
SCHEMBL18294 0.76 USP2 (0.69) USP2SMN1; SMN2POLBHTTATM
SCHEMBL698803 0.76 USP2 (0.69) USP2SMN1; SMN2POLBHTTATM
SCHEMBL2262506 0.76 ALDH1A1 (0.52) USP2SMN1; SMN2POLBHTTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4712961-A2 KRAS G12S AND G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2026-03-25 EP disclosed
WO-2024238633-A2 KRAS G12S AND G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2024-11-21 WO disclosed