SCHEMBL24880472

SCHEMBL24880472

CC(C)(C)OC(=O)N1CC=C(c2ccc(C(=O)O)nn2)CC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 11/20 0.61
GRM5 P41594 11/20 0.61
PDK4 Q16654 1/20 0.50
NAMPT P43490 1/20 0.47
HTR6 P50406 1/20 0.46
WNT3A P56704 1/20 0.44
JAK1 P23458 1/20 0.43
GPR119 Q8TDV5 1/20 0.43
CCNT1 O60563 1/20 0.42
CDK9 P50750 1/20 0.42
TNK2 Q07912 1/20 0.42

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
SCHEMBL31590064 0.89 GRM1 (0.56) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL2268829 0.85 GRM1 (0.59) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL30439311 0.85 GRM1 (0.59) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL31639564 0.85 GRM1 (0.59) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL15176153 0.85 GRM1 (0.59) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL24891853 0.83 GRM1 (0.57) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL2264461 0.82 GRM1 (0.56) GRM1GRM5PDK4NAMPTWNT3A
SCHEMBL31701242 0.81 GRM1 (0.55) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL64945 0.81 GRM1 (0.55) GRM1GRM5PDK4NAMPTHTR6
SCHEMBL13472360 0.81 GRM1 (0.54) GRM1GRM5PDK4NAMPTHTR6

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
CN-115594666-B Synthesis and application of phosphatase degradation agent 海创药业股份有限公司 2024-05-31 CN disclosed
EP-4368614-A1 SYNTHESIS AND APPLICATION OF PHOSPHATASE DEGRADER Hinova Pharmaceuticals Inc. (CN) 2024-05-15 EP disclosed
CN-115594666-A Synthesis and application of phosphatase degrading agent 海创药业股份有限公司(CN) 2023-01-13 CN disclosed
WO-2023280237-A1 SYNTHESIS AND APPLICATION OF PHOSPHATASE DEGRADER 海创药业股份有限公司 2023-01-12 WO disclosed