SCHEMBL19638643

SCHEMBL19638643

Cn1cc(-c2cc(CCN[SH](=O)=O)ccc2OC2CCOCC2)c2cc[nH]c2c1=O

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.64

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
SCHEMBL19638593 0.95 BRD4 (0.65) BRD4
SCHEMBL19638549 0.92 BRD4 (0.68) BRD4
SCHEMBL19638550 0.91 BRD4 (0.66) BRD4
SCHEMBL19638600 0.89 BRD4 (0.67) BRD4
SCHEMBL19638595 0.87 BRD4 (0.69) BRD4
SCHEMBL19638575 0.84 BRD4 (0.71) BRD4
SCHEMBL19638465 0.84 BRD4 (0.67) BRD4
SCHEMBL19638703 0.83 BRD4 (0.67) BRD4
SCHEMBL19638591 0.82 BRD4 (0.70) BRD4
SCHEMBL19638510 0.81 BRD4 (0.70) BRD4

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-2797918-B1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2017-11-29 EP claimed