SCHEMBL28534844

SCHEMBL28534844

COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)cc2c1C(=O)OC2=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ PDK2 Q15119 1/20 0.44
▸ ABCB1 P08183 4/20 0.44
▸ SUV39H2 Q9H5I1 3/20 0.44
▸ TLR9 Q9NR96 1/20 0.43
▸ GPR119 Q8TDV5 3/20 0.42
▸ ALK Q9UM73 3/20 0.42
▸ NAMPT P43490 1/20 0.41
▸ F13A1 P00488 1/20 0.41
▸ TGM2 P21980 1/20 0.41
▸ TGM1 P22735 1/20 0.41
▸ P2RX7 Q99572 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL30431090 1.00 LMNA (0.44) LMNAMAPTALDH1A1PDK2ABCB1
SCHEMBL29628994 0.82 ABCB1 (0.48) LMNAMAPTALDH1A1PDK2ABCB1
SCHEMBL20231723 0.82 ABCB1 (0.48) LMNAMAPTALDH1A1PDK2ABCB1
SCHEMBL2386587 0.78 SUV39H2 (0.55) LMNAMAPTALDH1A1PDK2ABCB1
SCHEMBL30726275 0.78 SUV39H2 (0.55) LMNAMAPTALDH1A1PDK2ABCB1
SCHEMBL31216276 0.77 ABCB1 (0.50) LMNAMAPTALDH1A1ABCB1SUV39H2
SCHEMBL31216180 0.76 ABCB1 (0.50) LMNAMAPTALDH1A1ABCB1SUV39H2
SCHEMBL12663222 0.74 ABCB1 (0.58) LMNAMAPTALDH1A1PDK2ABCB1
SCHEMBL23784871 0.74 MAPT (0.57) LMNAMAPTALDH1A1PDK2GPR119
SCHEMBL20046122 0.74 ABCB1 (0.50) LMNAMAPTALDH1A1PDK2ABCB1

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-112262134-B Cerebulin ligands and bifunctional compounds comprising same 阿尔维纳斯运营股份有限公司 2024-05-24 — — CN disclosed
CN-111892577-B Compounds and methods for androgen receptor targeted degradation 阿尔维纳斯运营股份有限公司 2023-07-07 — — CN disclosed
CN-112262134-A Cereblon ligand and bifunctional compound comprising same 阿尔维纳斯运营股份有限公司 2021-01-22 — — CN disclosed
CN-111892577-A Compounds and methods for targeted degradation of androgen receptor 阿尔维纳斯运营股份有限公司 2020-11-06 — — CN disclosed
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