SCHEMBL5315539

SCHEMBL5315539

CCOC(C)(OC)OC(OC(=O)Cc1ccncc1)(OC(C)(OC)OCC)OC(C)(OC)OCC

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 18/20 0.44
LMNA P02545 1/20 0.34
CYP17A1 P05093 2/20 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
SCHEMBL5315935 0.82 MAPT (0.40) LMNA
SCHEMBL5312191 0.80 CYP1A2 (0.40) LMNA
SCHEMBL5317681 0.72 NPC1 (0.41)
SCHEMBL5315540 0.71 CYP19A1 (0.45) CYP19A1CYP17A1
SCHEMBL304656 0.69 CYP19A1 (0.63) CYP19A1
SCHEMBL237854 0.69 CYP19A1 (0.59) CYP19A1
SCHEMBL5315543 0.68 CYP19A1 (0.49) CYP19A1CYP17A1
Hydrochloric Acid SCHEMBL4829936 0.67 CYP19A1 (0.57) CYP19A1
SCHEMBL7591822 0.65 CYP19A1 (0.61) CYP19A1LMNACYP17A1
SCHEMBL13360708 0.64 CYP19A1 (0.53) CYP19A1CYP17A1

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-1840158-A1 METHOD FOR VULCANIZATION AND ADHESION OF RUBBER COMPOSITION WITH ARTICLE TO BE ADHERED BEING MADE OF BRASS OR PLATED WITH BRASS, REINFORCING MATERIAL FOR RUBBER ARTICLE, RUBBER-REINFORCING MATERIAL COMPOSITE, AND PNEUMATIC TIRE Bridgestone Corporation (JP) 2007-10-03 EP disclosed