SCHEMBL13009192

SCHEMBL13009192

CCCC(/C=C/N=C=O)CC

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 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
SCHEMBL8290949 0.85 TSHR (0.41) TSHRSMN1; SMN2
SCHEMBL8291166 0.82 MAPT (0.34) TSHRSMN1; SMN2
SCHEMBL3438798 0.69
SCHEMBL11815254 0.67
SCHEMBL11350491 0.66
SCHEMBL11350492 0.66
SCHEMBL11144145 0.66
SCHEMBL9130536 0.64 TSHR (0.36) TSHRSMN1; SMN2
SCHEMBL19416862 0.64 TSHR (0.36) TSHRSMN1; SMN2
SCHEMBL29023653 0.64

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-1716160-B1 NOVEL INHIBITORS OF CHYMASE JANSSEN PHARMACEUTICA NV (BE) 2010-12-29 EP disclosed