SCHEMBL30003704

SCHEMBL30003704

Fc1ccc2ncccc2c1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
MAPT P10636 2/20 0.58
CYP3A4 P08684 1/20 0.47
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
MEN1 O00255 1/20 0.46
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
HIF1A Q16665 1/20 0.46
MPI P34949 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ERN1 O75460 2/20 0.41
NCOA1 Q15788 2/20 0.39
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
NR4A2 P43354 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL1133974 1.00 KDM4E (0.58) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL30387307 0.79 KDM4E (0.62) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL4054902 0.79 KDM4E (0.62) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL9654404 0.76 MAPT (0.58) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL26119594 0.76 MAPT (0.66) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL1464212 0.76 MAPT (0.66) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL8745778 0.76 KDM4E (0.58) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL3837008 0.76 MAPT (0.58) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL2179047 0.76 MAPT (0.58) KDM4EMAPTCYP3A4LMNAHTT
SCHEMBL430529 0.76 MAPT (0.58) KDM4EMAPTCYP3A4LMNAHTT

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
EP-4323372-A1 TRI-SUBSTITUTED INDOLE BINDING FUNCTION 3 (BF3) COMPOUNDS AND METHODS FOR THEIR USE The University Of British Columbia (CA) 2024-02-21 EP disclosed
WO-2022219541-A1 TRI-SUBSTITUTED INDOLE BINDING FUNCTION 3 (BF3) COMPOUNDS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2022-10-20 WO disclosed