SCHEMBL11277339

SCHEMBL11277339

COC(=O)C1=CCC=CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.43
LMNA P02545 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
THRB P10828 1/20 0.42
CHRM1 P11229 1/20 0.42
BLM P54132 1/20 0.41
MCOLN3 Q8TDD5 1/20 0.41
TSHR P16473 2/20 0.35
ALDH1A1 P00352 2/20 0.34
CFTR P13569 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PTPN1 P18031 1/20 0.34
CA12 O43570 5/20 0.33
CA1 P00915 5/20 0.33
CA2 P00918 5/20 0.33
CA7 P43166 5/20 0.33
CA9 Q16790 5/20 0.33
CA14 Q9ULX7 5/20 0.33

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
SCHEMBL5798986 0.82
SCHEMBL10431184 0.80 CHRM3 (0.50) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL6966235 0.79
SCHEMBL158805 0.76
SCHEMBL9168568 0.75
SCHEMBL8569735 0.74 KDM4E (0.30) KDM4ETDP1
SCHEMBL8947531 0.74
SCHEMBL6973635 0.73
SCHEMBL1046193 0.73
SCHEMBL7632368 0.72 CHRM3 (0.40) CHRM3LMNACHRM2CHRM4CHRM5

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-0046377-A1 Cycloalkenylcarboxamido derivatives of tetramisole, their preparation and use in medicine BEECHAM GROUP PLC (GB) 1982-02-24 EP disclosed