SCHEMBL25756470

SCHEMBL25756470

COC(=O)[C@H]1C[C@]2(CN1)C(=O)Nc1ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 11/20 1.00
▸ KMT2A Q03164 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PDK2 Q15119 1/20 0.39
▸ PDK4 Q16654 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ TDO2 P48775 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ OPRL1 P41146 1/20 0.38
▸ SNRNP200 O75643 1/20 0.37

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
SCHEMBL3667532 1.00 BACE1 (1.00) BACE1KMT2ALMNAMAPTPDK2
SCHEMBL25250527 1.00 BACE1 (1.00) BACE1KMT2ALMNAMAPTPDK2
SCHEMBL3667620 1.00 BACE1 (1.00) BACE1KMT2ALMNAMAPTPDK2
SCHEMBL30471238 0.84 BACE1 (0.72) BACE1LMNAMAPTPDK2PDK4
SCHEMBL24458972 0.83 BACE1 (0.71) BACE1KMT2AIDO1
SCHEMBL24448446 0.83 BACE1 (0.71) BACE1KMT2AIDO1
SCHEMBL24459149 0.83 BACE1 (0.70) BACE1KMT2APDK2PDK4IDO1
SCHEMBL30536706 0.83 BACE1 (0.70) BACE1KMT2APDK2PDK4IDO1
SCHEMBL24403333 0.83 BACE1 (0.70) BACE1KMT2APDK2PDK4IDO1
SCHEMBL26312575 0.83 BACE1 (0.70) BACE1KMT2APDK2PDK4IDO1

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-2023109926-A1 SPIROOXINDOLE COMPOUND AND USE THEREOF IN PREPARATION OF PROTEASE INHIBITOR AS ANTIVIRAL DRUG 南京药石科技股份有限公司 2023-06-22 — — WO disclosed
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