SCHEMBL19657630

SCHEMBL19657630

C=C(C)N1CCCc2cc(N3CCCc4cc(-c5cnn(C)c5)c(C(F)F)cc43)ccc21

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 20/20 0.84
BRD4 O60885 4/20 0.84
EP300 Q09472 1/20 0.66

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
SCHEMBL19644549 0.91 CREBBP (1.00) CREBBPBRD4EP300
SCHEMBL24258488 0.81 CREBBP (0.67) CREBBPBRD4EP300
SCHEMBL19657375 0.80 CREBBP (0.81) CREBBPBRD4EP300
SCHEMBL19657582 0.80 CREBBP (0.71) CREBBPBRD4EP300
SCHEMBL19657877 0.79 CREBBP (0.67) CREBBPBRD4EP300
SCHEMBL19657643 0.79 CREBBP (1.00) CREBBPBRD4EP300
SCHEMBL19657653 0.79 CREBBP (1.00) CREBBPBRD4EP300
SCHEMBL30117224 0.79 CREBBP (1.00) CREBBPBRD4EP300
SCHEMBL19657370 0.79 CREBBP (0.74) CREBBPBRD4EP300
SCHEMBL19657950 0.79 CREBBP (0.65) CREBBPBRD4EP300

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-2017205536-A2 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 WO disclosed