SCHEMBL29744827

SCHEMBL29744827

Cc1cc(N)ccc1C1=CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK4 Q16654 1/20 0.55
NR1H2 P55055 1/20 0.54
GRM1 Q13255 10/20 0.50
GRM5 P41594 9/20 0.50
HTR6 P50406 1/20 0.48
JAK1 P23458 1/20 0.48
NAMPT P43490 1/20 0.47
CNR1 P21554 1/20 0.46
GABRP O00591 1/20 0.45
GABRD O14764 1/20 0.45
GABRA1 P14867 1/20 0.45
GABRB1 P18505 1/20 0.45
GABRG2 P18507 1/20 0.45
GABRB3 P28472 1/20 0.45
GABRA5 P31644 1/20 0.45
GABRA3 P34903 1/20 0.45
GABRA2 P47869 1/20 0.45
GABRB2 P47870 1/20 0.45
GABRA4 P48169 1/20 0.45
GABRE P78334 1/20 0.45

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
SCHEMBL1811363 1.00 PDK4 (0.55) PDK4NR1H2GRM1GRM5HTR6
SCHEMBL20112166 0.89 PDK4 (0.58) PDK4GRM1GRM5HTR6JAK1
SCHEMBL21245850 0.88 PDK4 (0.53) PDK4NR1H2GRM1GRM5HTR6
SCHEMBL24629831 0.87 PDK4 (0.54) PDK4NR1H2GRM1GRM5HTR6
SCHEMBL29744751 0.87 PDK4 (0.54) PDK4NR1H2GRM1GRM5HTR6
SCHEMBL29535547 0.87 PDK4 (0.54) PDK4NR1H2GRM1GRM5HTR6
SCHEMBL31444034 0.87 PDK4 (0.54) PDK4NR1H2GRM1GRM5HTR6
SCHEMBL6402391 0.87 PDK4 (0.54) PDK4NR1H2GRM1GRM5HTR6
SCHEMBL25936245 0.87 PDK4 (0.56) PDK4GRM1GRM5HTR6JAK1
SCHEMBL17398182 0.86 PDK4 (0.53) PDK4NR1H2GRM1GRM5HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114901277-B Isoindolinone and indazole compounds for EGFR degradation C4医药公司 2024-05-17 CN disclosed
EP-4366834-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS Biogen MA Inc. (US) 2024-05-15 EP disclosed
EP-4347044-A2 EGFR DEGRADERS TO TREAT CANCER METASTASIS TO THE BRAIN OR CNS C4 Therapeutics, Inc. (US) 2024-04-10 EP disclosed
WO-2023283372-A1 COMPOUNDS FOR TARGETING DEGRADATION OF IRAK4 PROTEINS BIOGEN MA INC. (US) 2023-01-12 WO disclosed
WO-2022251539-A2 EGFR DEGRADERS TO TREAT CANCER METASTASIS TO THE BRAIN OR CNS C4 THERAPEUTICS, INC. (US) 2022-12-01 WO disclosed
EP-4076450-A1 ISOINDOLINONE AND INDAZOLE COMPOUNDS FOR THE DEGRADATION OF EGFR C4 Therapeutics, Inc. (US) 2022-10-26 EP disclosed
CN-114901277-A Isoindolinone and indazole compounds for EGFR degradation C4医药公司 2022-08-12 CN disclosed