SCHEMBL25059000

SCHEMBL25059000

Cc1ccc2c(c1)c1ccc(C)cc1n2I

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
KDM4E B2RXH2 5/20 0.37
MAPT P10636 4/20 0.37
RAB9A P51151 2/20 0.37
APAF1 O14727 1/20 0.37
PKM P14618 1/20 0.37
IDO1 P14902 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
MCL1 Q07820 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NR1I2 O75469 1/20 0.34
AHR P35869 1/20 0.34
PGR P06401 1/20 0.34
RORA P35398 1/20 0.34
RORC P51449 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
SCHEMBL18799899 0.91 CYP1A2 (0.38) ACHEKDM4EMAPTTDP1NR1I2
SCHEMBL18799928 0.91 KDM4E (0.40) BCHEACHEKDM4EMAPTRAB9A
SCHEMBL17750896 0.86 BCHE (0.44) BCHEACHEKDM4EMAPTMAPK1
SCHEMBL20402776 0.86 GPR3 (0.41) BCHEACHEKDM4EMAPTHTT
SCHEMBL25882732 0.86 TSHR (0.41) MAPTMCL1TDP1PGRRORA
SCHEMBL23518921 0.82 KDM4E (0.35) BCHEACHEKDM4EMAPTRAB9A
SCHEMBL22906839 0.78 ACHE (0.42) ACHEMAPTCYP2A6
SCHEMBL20121819 0.77 LMNA (0.37) MAPTMAPK1HTTTDP1MEN1
SCHEMBL24728493 0.77 PARP10 (0.33) BCHEACHEKDM4EIDO1CYP2A6
SCHEMBL20466817 0.77 BCHE (0.54) BCHEACHEKDM4EMAPTRAB9A

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
EP-4137551-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-02-22 EP disclosed