SCHEMBL20155554

SCHEMBL20155554

Cn1cc2c(=O)n(C)cc(-c3cc(N)ccc3Oc3ccc(Cl)cc3Cl)c2n1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 14/20 0.42
BRDT Q58F21 1/20 0.37
FPR2 P25090 1/20 0.36
PROKR1 Q8TCW9 1/20 0.36
F2RL3 Q96RI0 1/20 0.35
MAT2A P31153 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL20155411 0.90 BRD4 (0.47) BRD4
SCHEMBL20155006 0.90 BRD4 (0.46) BRD4
SCHEMBL20155360 0.89 BRD4 (0.49) BRD4BRDTALDH1A1HPGD
SCHEMBL20155028 0.88 BRD4 (0.41) BRD4ALDH1A1GAA
SCHEMBL20155702 0.85 BRD4 (0.40) BRD4BRDTMAT2A
SCHEMBL20155002 0.78 BRD4 (0.49) BRD4
SCHEMBL20155476 0.78 BRD4 (0.43) BRD4
SCHEMBL20155478 0.78 BRD4 (0.43) BRD4
SCHEMBL20155737 0.76 BRD4 (0.47) BRD4MAT2A
SCHEMBL20155083 0.76 BRD4 (0.54) 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
WO-2018086604-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF 山东罗欣药业集团股份有限公司 2018-05-17 WO disclosed