SCHEMBL31433587

SCHEMBL31433587

Cn1nc(-c2ccc(OCc3ccccc3)nc2OCc2ccccc2)c2cc(F)c(C3=CCN(C(=O)OC(C)(C)C)CC3)c(F)c21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.39
GRM1 Q13255 6/20 0.39
PDK4 Q16654 1/20 0.39
GPR119 Q8TDV5 1/20 0.38
CDK9 P50750 4/20 0.38
TNK2 Q07912 1/20 0.37
HTR6 P50406 1/20 0.37
PDE10A Q9Y233 1/20 0.37
TNF P01375 1/20 0.36
CCNT1 O60563 2/20 0.36
TLR9 Q9NR96 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
BTK Q06187 1/20 0.36
JAK1 P23458 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CCNA1 P78396 1/20 0.35

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
SCHEMBL31434048 0.92 GPR119 (0.35) GRM5GRM1PDK4GPR119CDK9
SCHEMBL26924679 0.91 GRM5 (0.41) GRM5GRM1PDK4GPR119TNK2
SCHEMBL30731864 0.91 GRM5 (0.41) GRM5GRM1PDK4GPR119TNK2
SCHEMBL31433805 0.90 YAP1 (0.36) GPR119CDK9CCNT1TLR9TLR7
SCHEMBL31433920 0.90 GPR119 (0.35) GPR119CDK9TNFCCNT1TLR9
SCHEMBL31433974 0.90 GPR119 (0.35) GPR119CDK9TNFCCNT1TLR9
SCHEMBL31433941 0.90 GPR119 (0.35) GPR119CDK9TNFCCNT1TLR9
SCHEMBL31433646 0.88 GPR119 (0.33) GRM5GRM1GPR119CDK9PDE10A
SCHEMBL31433745 0.88 GPR119 (0.33) GRM5GRM1GPR119CDK9PDE10A
SCHEMBL30732152 0.88 TNF (0.44) GRM5GRM1PDK4GPR119CDK9

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
WO-2025049964-A1 BCL6 BIFUNCTIONAL DEGRADERS Treeline Biosciences, Inc. (US) 2025-03-06 WO disclosed
WO-2025050016-A1 TRICYCLIC QUINOLONE BCL6 BIFUNCTIONAL DEGRADERS Treeline Biosciences, Inc. (US) 2025-03-06 WO disclosed