SCHEMBL28114450

SCHEMBL28114450

O=C(O)c1cn(I)c2cc(Br)ccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
GLA P06280 1/20 0.40
CAPN1 P07384 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3R1 P27986 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CG P48736 1/20 0.38
MYC P01106 1/20 0.38
NR4A1 P22736 1/20 0.38
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GPR35 Q9HC97 1/20 0.37

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
SCHEMBL23362197 0.82 LMNA (0.48) LMNAKDM4EMEN1KMT2ARXFP1
SCHEMBL29640631 0.82 LMNA (0.48) LMNAKDM4EMEN1KMT2ARXFP1
SCHEMBL7578838 0.80 KDM4E (0.59) LMNAKDM4EMEN1KMT2APIK3CD
SCHEMBL29576694 0.80 KDM4E (0.59) LMNAKDM4EMEN1KMT2APIK3CD
SCHEMBL29744413 0.78 MYC (0.38) LMNAKDM4EMEN1KMT2ARXFP1
SCHEMBL23497662 0.78 MYC (0.38) LMNAKDM4EMEN1KMT2ARXFP1
SCHEMBL7121601 0.77 KDM4E (0.69) LMNAKDM4EMEN1KMT2ARXFP1
SCHEMBL2070531 0.75 LMNA (0.71) LMNA
SCHEMBL10474320 0.75 LMNA (0.55) LMNAKDM4EMEN1KMT2ACAPN1
SCHEMBL18589519 0.73 LMNA (0.54) LMNAKDM4EMEN1KMT2A

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
CN-106132422-A Adoptive cell therapy using agonists of retinoic acid receptor-associated orphan receptor gamma & related therapeutic methods 莱斯拉公司 2016-11-16 CN disclosed