SCHEMBL8972758

SCHEMBL8972758

COc1ccc(C(CCCCCCCCCCCCCCCCO)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 16/20 0.68
KCNH2 Q12809 1/20 0.68
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LTA4H P09960 1/20 0.40

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
SCHEMBL7708779 0.98 KIF11 (0.69) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL22150730 0.97 KIF11 (0.71) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL28515838 0.87 KIF11 (0.66) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL5058831 0.87 KIF11 (0.66) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL9172236 0.85 KIF11 (0.57) KIF11KCNH2
SCHEMBL29060869 0.84 KIF11 (0.88) KIF11KCNH2SMN1; SMN2
SCHEMBL9395267 0.84 KIF11 (0.62) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL19809495 0.84 KIF11 (0.62) KIF11KCNH2HTT
SCHEMBL7453762 0.83 KIF11 (0.59) KIF11KCNH2
SCHEMBL8724574 0.82 KIF11 (0.61) KIF11KCNH2LMNAHTTSMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0416817-B1 Amplification processes ZENECA LTD (GB) 1996-10-16 EP disclosed
US-5525494-A Amplification processes ZENECA LIMITED (GB) 1996-06-11 US disclosed
EP-0416817-A2 Amplification processes ZENECA LIMITED (GB) 1991-03-13 EP disclosed