SCHEMBL28535932

SCHEMBL28535932

CC(C)(C)OC(=O)C=CC(=O)OC1CCC(O)CC1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 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
SCHEMBL21614517 1.00 CHRM2 (0.37) CHRM2CHRM1CHRM3
SCHEMBL24183731 1.00 CHRM2 (0.37) CHRM2CHRM1CHRM3
SCHEMBL21614537 1.00 CHRM2 (0.37) CHRM2CHRM1CHRM3
SCHEMBL21614507 0.86 NAAA (0.39)
SCHEMBL16704232 0.85 ATM (0.35)
SCHEMBL29676897 0.84 NAAA (0.40)
SCHEMBL7537157 0.84 NAAA (0.40)
SCHEMBL3516768 0.84 NAAA (0.40)
SCHEMBL21614535 0.79 APOBEC3A (0.33)
SCHEMBL21614534 0.79 APOBEC3A (0.33)

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-112424170-A Novel compounds for controlling arthropods 拜耳动物保健有限责任公司 2021-02-26 CN disclosed