SCHEMBL9017076

SCHEMBL9017076

CC1(C)CC(N(C(N)=S)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.40
GAA P10253 1/20 0.33
ALOX15 P16050 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
SCHEMBL4459766 0.76 ALOX15 (0.37) RECQLGAAALOX15
SCHEMBL9350995 0.74 ALOX15 (0.41) RECQLGAAALOX15
SCHEMBL8335947 0.73 ALOX15 (0.38) RECQLGAAALOX15
SCHEMBL8495893 0.71 GAA (0.34) GAAALOX15
SCHEMBL9264716 0.70 RECQL (0.33) RECQLALOX15
SCHEMBL4009873 0.70 GAA (0.33) GAAALOX15
SCHEMBL11547014 0.69 GAA (0.38) RECQLGAAALOX15
SCHEMBL9355007 0.69 GAA (0.38) RECQLGAAALOX15
SCHEMBL11099842 0.69 ALOX15 (0.41) RECQLGAAALOX15
SCHEMBL21163212 0.69 RECQL (0.35) RECQLALOX15

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-0379470-B1 Improved dyeability of synthetic polyamide SANDOZ AG (CH) 1996-03-20 EP disclosed