SCHEMBL2594416

SCHEMBL2594416

Cn1ccc(Br)c(Br)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 2/20 0.39
BRD4 O60885 1/20 0.39
TAF1 P21675 1/20 0.39
BRPF1 P55201 1/20 0.39
CREBBP Q92793 1/20 0.39
CECR2 Q9BXF3 1/20 0.39
CRBN Q96SW2 2/20 0.37
MAPT P10636 4/20 0.36
CYP2C9 P11712 2/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
HTT P42858 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
RXFP1 Q9HBX9 2/20 0.35
XBP1 P17861 1/20 0.35
KDM4E B2RXH2 2/20 0.34
KDM6A O15550 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
SCHEMBL20516739 0.79 BRD4 (0.38) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL29911927 0.79 BRD9 (0.38) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL15717311 0.77 BRD9 (0.37) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL25344358 0.77 BRD9 (0.37) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL19785547 0.77 BRD9 (0.37) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL31439950 0.77 ATAD2 (0.39) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL21957151 0.74 MAPT (0.56) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL28956221 0.74 TRIM24 (0.36) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL22990507 0.73 BRD4 (0.34) BRD9BRD4TAF1BRPF1CREBBP
SCHEMBL25331540 0.73 LMNA (0.59) BRD9BRD4TAF1BRPF1CREBBP

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117295730-A Process for preparing BTK inhibitor 豪夫迈·罗氏有限公司 2023-12-26 CN disclosed
EP-2566869-A1 PYRIDONE AND AZA-PYRIDONE COMPOUNDS AND METHODS OF USE Gilead Connecticut, Inc. (US) 2013-03-13 EP disclosed
WO-2011140488-A1 PYRIDONE AND AZA-PYRIDONE COMPOUNDS AND METHODS OF USE GILEAD CONNECTICUT, INC. (US) 2011-11-10 WO disclosed