SCHEMBL8196017

SCHEMBL8196017

C1CC(COc2nsnc2O[C@@H]2C[C@H]3CC[C@@H]2C3)C1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 6/20 0.36
ACACB O00763 1/20 0.34
PDGFRB P09619 2/20 0.33
PDGFRA P16234 2/20 0.33
CDK2 P24941 1/20 0.30
CYP19A1 P11511 1/20 0.30

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
SCHEMBL8197788 0.81 CHRM1 (0.41) CHRM1ACACBPDGFRBPDGFRACYP19A1
SCHEMBL8183402 0.76 CHRM1 (0.37) CHRM1PDGFRBPDGFRA
SCHEMBL6784661 0.75 CHRM1 (0.58) CHRM1
SCHEMBL8198118 0.74 PDGFRB (0.34) PDGFRBPDGFRA
SCHEMBL8196587 0.72 ALDH1A1 (0.40) CHRM1CYP19A1
SCHEMBL8196015 0.71 MEN1 (0.32) CHRM1
SCHEMBL7885725 0.71 CHRM1 (0.61) CHRM1
SCHEMBL6989733 0.71 CHRM1 (0.33) CHRM1CDK2
SCHEMBL8191689 0.71 CHRM1 (0.40) CHRM1PDGFRBPDGFRACYP19A1
SCHEMBL8193676 0.70 CHRM1 (0.33) CHRM1ACACBPDGFRBPDGFRACYP19A1

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
US-6124312-A ACTIVE DRUG FOR TREATING ALZHEIMER'S DISEASE ELI LILLY AND COMPANY (US) 2000-09-26 US claimed