SCHEMBL31433780

SCHEMBL31433780

CC(C)(C)OC(=O)N1CC=C(c2ccc3cn(COCC[Si](C)(C)C)nc3c2F)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 11/20 0.45
GRM5 P41594 10/20 0.45
PDK4 Q16654 1/20 0.42
HTR6 P50406 1/20 0.40
JAK1 P23458 1/20 0.40
ENPP2 Q13822 1/20 0.39
EED O75530 3/20 0.39
RBBP4 Q09028 3/20 0.39
SUZ12 Q15022 3/20 0.39
EZH2 Q15910 3/20 0.39
NAMPT P43490 1/20 0.39
GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL34468854 0.85 GRM1 (0.46) GRM1GRM5PDK4HTR6JAK1
SCHEMBL31433915 0.83 TNF (0.45) GRM1GRM5PDK4HTR6JAK1
SCHEMBL31433719 0.83 GRM1 (0.43) GRM1GRM5PDK4JAK1EED
SCHEMBL25305978 0.82 GRM1 (0.47) GRM1GRM5PDK4HTR6ENPP2
SCHEMBL31434010 0.79 CNR1 (0.42) NAMPTGPR119
SCHEMBL29319317 0.75 KIT (0.44) GRM1GRM5PDK4HTR6EED
SCHEMBL31433997 0.74 TNF (0.44) GRM1GRM5PDK4HTR6JAK1
SCHEMBL31164588 0.74 GRM1 (0.40) GRM1GRM5PDK4HTR6JAK1
SCHEMBL12874666 0.74 GRM1 (0.49) GRM1GRM5PDK4HTR6EED
SCHEMBL29907270 0.74 PDK4 (0.49) GRM1GRM5PDK4HTR6EED

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
WO-2025050016-A1 TRICYCLIC QUINOLONE BCL6 BIFUNCTIONAL DEGRADERS Treeline Biosciences, Inc. (US) 2025-03-06 WO disclosed