SCHEMBL15925880

SCHEMBL15925880

Cc1noc2c1-c1ccc(-c3ccc(N)nc3)cc1C(c1ccc(F)cc1)=N[C@@H]2C

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 19/20 0.59
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35

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
SCHEMBL16303824 1.00 BRD4 (0.59) BRD4PIK3CDPIK3CAMTOR
SCHEMBL15925879 0.84 BRD4 (0.73) BRD4
SCHEMBL14756066 0.84 BRD4 (0.84) BRD4
SCHEMBL16738351 0.84 BRD4 (0.84) BRD4
SCHEMBL16303822 0.81 BRD4 (0.49) BRD4
SCHEMBL15925878 0.81 BRD4 (0.49) BRD4
SCHEMBL16306561 0.81 BRD4 (0.46) BRD4
SCHEMBL15926491 0.81 BRD4 (0.46) BRD4
SCHEMBL9974006 0.79 BRD4 (0.54) BRD4
SCHEMBL16303825 0.78 BRD4 (0.45) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796261-B2 Bromodomain inhibitors and uses thereof CONSTELLATION PHARMACEUTICALS, INC. (US) 2014-08-05 US disclosed
US-8796261-B2 Bromodomain inhibitors and uses thereof CONSTELLATION PHARMACEUTICALS, INC. (US) 2014-08-05 US disclosed