SCHEMBL24475293

SCHEMBL24475293

CN1C2CC(OC(=O)Cc3ccccc3)C[C@H]1C(O)C2

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
STS P08842 7/20 0.47
CHRM2 P08172 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46

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
SCHEMBL13175813 0.87 CHRM2 (0.54) STSCHRM2CHRM1CHRM3
SCHEMBL6105386 0.84 STS (0.46) STSCHRM2CHRM1CHRM3
SCHEMBL6105382 0.84 STS (0.46) STSCHRM2CHRM1CHRM3
SCHEMBL13698870 0.83 HTR3E (0.63) STSCHRM2CHRM1CHRM3
SCHEMBL5791676 0.83 HTR3E (0.63) STSCHRM2CHRM1CHRM3
SCHEMBL5790060 0.83 HTR3E (0.63) STSCHRM2CHRM1CHRM3
SCHEMBL16072425 0.80 CHRM1 (0.61) STSCHRM2CHRM1CHRM3
SCHEMBL28258808 0.79 ALDH1A1 (0.49) STS
Anisodamine SCHEMBL620576 0.77 CHRM1 (0.72) CHRM2CHRM1CHRM3
Anisodamine SCHEMBL31098813 0.77 CHRM1 (0.72) CHRM2CHRM1CHRM3

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-20220170026-A1 TROPANE ALKALOID (TA) PRODUCING NON-PLANT HOST CELLS, AND METHODS OF MAKING AND USING THE SAME HERCULES CAPITAL, INC., AS AGENT 2022-06-02 US disclosed