SCHEMBL21083259

SCHEMBL21083259

CCC(CC)C(C)(C)OF

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL6768822 0.75 TSHR (0.32) TSHR
SCHEMBL8442801 0.71
SCHEMBL6920593 0.71
SCHEMBL5909039 0.65 TSHR (0.32) TSHR
SCHEMBL11743054 0.65 TSHR (0.33) ALDH1A1TSHR
SCHEMBL11217684 0.65 ALDH1A1 (0.32) ALDH1A1TSHRTDP1
SCHEMBL23170211 0.65 TSHR (0.33) TSHR
SCHEMBL23169279 0.65
SCHEMBL14838414 0.65
SCHEMBL17815836 0.65

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-2064244-B1 ANTIBODIES DIRECTED TO alphaVbeta6 AND USES THEREOF MEDIMMUNE LTD (GB) 2019-06-05 EP disclosed