SCHEMBL23097680

SCHEMBL23097680

Cc1ccccc1N1CCN(C[C@H](O)COc2ccc(O)cc2)CC1

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 17/20 0.76
HSP90AB1 P08238 1/20 0.68
MAPT P10636 1/20 0.62

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
SCHEMBL8007076 1.00 ABCB1 (0.76) ABCB1HSP90AB1MAPT
Hydrochloric Acid SCHEMBL11814920 0.88 ABCB1 (0.73) ABCB1HSP90AB1
SCHEMBL2021898 0.87 HTR7 (0.74) ABCB1MAPT
SCHEMBL2021899 0.87 HTR7 (0.74) ABCB1MAPT
SCHEMBL2021902 0.87 HTR7 (0.74) ABCB1MAPT
SCHEMBL2021392 0.86 LMNA (0.73) ABCB1MAPT
SCHEMBL2021391 0.86 LMNA (0.73) ABCB1MAPT
SCHEMBL2021389 0.86 LMNA (0.73) ABCB1MAPT
SCHEMBL9815962 0.85 ABCB1 (0.77) ABCB1
SCHEMBL2022084 0.84 HSP90AB1 (0.69) ABCB1HSP90AB1MAPT

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
EP-2170334-B1 NMDA RECEPTOR ANTAGONISTS FOR NEUROPROTECTION UNIV EMORY (US) 2021-03-17 EP disclosed