SCHEMBL25928450

SCHEMBL25928450

CC(C)(C)OC(=O)N1CC=C(c2ccc(OCc3ccccc3)cc2)C(C)(C)C1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 8/20 0.47
▸ YAP1 P46937 3/20 0.45
▸ GPR119 Q8TDV5 2/20 0.41
▸ NR4A2 P43354 2/20 0.40
▸ MAOB P27338 1/20 0.40
▸ AMPD2 Q01433 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ OPRD1 P41143 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ LTA4H P09960 1/20 0.39
▸ NR4A1 P22736 1/20 0.39
▸ NR4A3 Q92570 1/20 0.39

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
SCHEMBL31306775 0.89 PRMT5 (0.46) PRMT5YAP1GPR119NR4A2MAOB
SCHEMBL8195218 0.80 NAMPT (0.57) PRMT5YAP1GPR119
SCHEMBL2160148 0.79 MEN1 (0.46) —
SCHEMBL25936712 0.78 NAMPT (0.50) PRMT5YAP1GPR119
SCHEMBL16874689 0.77 PRMT5 (0.50) PRMT5YAP1GPR119LTA4H
SCHEMBL29197711 0.74 PRMT5 (0.38) PRMT5GPR119OPRD1OPRK1
SCHEMBL25845395 0.74 PRMT5 (0.49) PRMT5YAP1GPR119NR4A2MAOB
SCHEMBL20475182 0.73 PRMT5 (0.48) PRMT5YAP1GPR119NR4A2MAOB
SCHEMBL21877176 0.73 YAP1 (0.52) PRMT5YAP1GPR119MAOBLTA4H
SCHEMBL31639554 0.73 NR1H2 (0.45) GPR119

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
CN-118574821-A Compounds and their use in the treatment of cancer 阿斯利康(瑞典)有限公司 2024-08-30 — — CN disclosed
WO-2023139199-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-07-27 — — WO disclosed
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