SCHEMBL27596325

SCHEMBL27596325

C=CCN(C)CCCCCCCOC1CCC(N(C)C(=O)Nc2ccc(C(C)(C)C)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.52
LSS P48449 15/20 0.49
ATM Q13315 1/20 0.36
MAPT P10636 1/20 0.36
USP30 Q70CQ3 2/20 0.35

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
SCHEMBL27596326 1.00 RAB9A (0.52) RAB9ALSSATMMAPTUSP30
SCHEMBL28749418 0.99 RAB9A (0.53) RAB9ALSSATMMAPTUSP30
SCHEMBL28749416 0.99 RAB9A (0.53) RAB9ALSSATMMAPTUSP30
SCHEMBL4804936 0.93 LSS (0.56) RAB9ALSSUSP30
SCHEMBL4804939 0.93 LSS (0.56) RAB9ALSSUSP30
SCHEMBL4807825 0.90 LSS (0.51) RAB9ALSSATMMAPT
SCHEMBL4803072 0.90 LSS (0.51) RAB9ALSSATMMAPT
SCHEMBL4803363 0.90 LSS (0.51) RAB9ALSSATMMAPT
SCHEMBL4807837 0.90 LSS (0.51) RAB9ALSSATMMAPT
SCHEMBL4803067 0.90 LSS (0.51) RAB9ALSSATMMAPT

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
CN-1468214-A Novel derivatives of aminocyclohexane - 2004-01-14 CN disclosed