SCHEMBL26002941

SCHEMBL26002941

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OC(=O)CSSCC(N)=O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLA1 P09884 1/20 0.69
▸ CYP46A1 Q9Y6A2 2/20 0.67
▸ OSBP P22059 3/20 0.63
▸ USP2 O75604 2/20 0.63
▸ RORC P51449 2/20 0.63
▸ LMNA P02545 1/20 0.63
▸ ABCB1 P08183 1/20 0.63
▸ OSBP2 Q969R2 1/20 0.63
▸ NR1H3 Q13133 3/20 0.56
▸ PLA2G2A P14555 1/20 0.56
▸ NPC1L1 Q9UHC9 2/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ GBA1 P04062 2/20 0.55
▸ UGCG Q16739 2/20 0.55
▸ GBA2 Q9HCG7 2/20 0.55
▸ GRIN1 Q05586 1/20 0.54
▸ GRIN2A Q12879 1/20 0.54
▸ FGF2 P09038 1/20 0.53

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
SCHEMBL25352111 0.93 POLA1 (0.74) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL25352092 0.93 POLA1 (0.74) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL16330226 0.90 POLA1 (0.71) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL25992010 0.89 POLA1 (0.62) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL30862603 0.89 POLA1 (0.75) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL30862600 0.89 POLA1 (0.75) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL17149739 0.89 POLA1 (0.75) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL30862601 0.89 POLA1 (0.75) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL12500755 0.89 POLA1 (0.75) POLA1CYP46A1OSBPUSP2RORC
SCHEMBL4370706 0.89 POLA1 (0.75) POLA1CYP46A1OSBPUSP2RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023154818-A1 MUCOSAL ADMINISTRATION METHODS AND FORMULATIONS MODERNATX, INC. (US) 2023-08-17 — — WO disclosed
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