SCHEMBL30405602

SCHEMBL30405602

CC(C)(C)OC(=O)N1CCc2nc(N3CCN(c4ncccn4)CC3)ncc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 1.00
HSP90AB1 P08238 8/20 0.60
GPR119 Q8TDV5 1/20 0.54
LMNA P02545 3/20 0.54
TP53 P04637 2/20 0.52
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL21527992 0.89 MAPT (0.81) MAPTHSP90AB1GPR119LMNA
SCHEMBL30363533 0.89 MAPT (0.81) MAPTHSP90AB1GPR119LMNA
SCHEMBL21528007 0.87 MAPT (0.77) MAPTHSP90AB1
SCHEMBL31046962 0.87 MAPT (0.77) MAPTHSP90AB1
SCHEMBL1017921 0.87 MAPT (0.77) MAPTHSP90AB1SMN1; SMN2
SCHEMBL30405552 0.86 MAPT (0.75) MAPTHSP90AB1GPR119LMNATP53
SCHEMBL21528138 0.85 MAPT (0.74) MAPTHSP90AB1GPR119LMNATP53
SCHEMBL30805644 0.85 MAPT (0.74) MAPTHSP90AB1GPR119LMNATP53
SCHEMBL4074301 0.85 MAPT (0.73) MAPTHSP90AB1GPR119
SCHEMBL21528035 0.84 MAPT (0.72) MAPTHSP90AB1LMNATP53POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4168002-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS Revolution Medicines, Inc. (US) 2023-04-26 EP disclosed