SCHEMBL17680975

SCHEMBL17680975

C=C1C[C@@H](C)Nc2c(cccc2C(=O)Nc2ccccc2)N1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 20/20 0.77
BRD4 O60885 16/20 0.77

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
SCHEMBL17673178 0.87 CREBBP (1.00) CREBBPBRD4
SCHEMBL17680721 0.79 CREBBP (1.00) CREBBPBRD4
SCHEMBL22368827 0.77 CREBBP (0.48) CREBBPBRD4
SCHEMBL19518266 0.77 CREBBP (0.81) CREBBPBRD4
SCHEMBL17680852 0.77 CREBBP (0.81) CREBBPBRD4
SCHEMBL17673205 0.77 CREBBP (0.81) CREBBPBRD4
SCHEMBL17680757 0.76 CREBBP (1.00) CREBBPBRD4
SCHEMBL17673148 0.75 CREBBP (1.00) CREBBPBRD4
SCHEMBL22368700 0.74 CREBBP (0.45) CREBBPBRD4
SCHEMBL17680883 0.74 CREBBP (1.00) CREBBPBRD4

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
WO-2016055028-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-04-14 WO disclosed