SCHEMBL11779604

SCHEMBL11779604

CC(C)Oc1nc([NH])nc(Cl)n1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 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
SCHEMBL1968887 0.84 ALDH1A1 (0.42) GAATDP1
SCHEMBL6051489 0.84 GAA (0.36) GAATDP1
SCHEMBL32687993 0.77 CYP1A2 (0.41) GAATDP1
SCHEMBL9190048 0.76 CYP1A2 (0.44)
SCHEMBL8634269 0.75 HSP90AA1 (0.46) GAATDP1
SCHEMBL2029438 0.71 TP53 (0.33)
SCHEMBL479536 0.68
SCHEMBL20541970 0.67 PTGS1 (0.33)
SCHEMBL11130998 0.67 ALDH1A1 (0.38) GAATDP1
SCHEMBL9818504 0.67

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
US-3933785-A Azo compounds CIBA-GEIGY AG (CH) 1976-01-20 US claimed
US-3971738-A Heavy metal complexes of azo compounds containing a halogeno-2,3-dihydroxy pyridine coupling component CIBA-GEIGY AG (CH) 1976-07-27 US disclosed
US-3933785-A Azo compounds CIBA-GEIGY AG (CH) 1976-01-20 US disclosed