SCHEMBL21730740

SCHEMBL21730740

Cc1ccc(-c2ccccc2-c2ccc(I)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
POLB P06746 2/20 0.44
LMNA P02545 3/20 0.39
ACHE P22303 2/20 0.39
TSHR P16473 2/20 0.39
ALOX12 P18054 1/20 0.39
RAB9A P51151 8/20 0.39
NPC1 O15118 7/20 0.39
SYK P43405 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
NR2F2 P24468 1/20 0.38
HTT P42858 1/20 0.38
HPRT1 P00492 1/20 0.38
RCE1 Q9Y256 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
SCHEMBL7649931 0.87 ABL1 (0.42) HPGDALDH1A1PTGS2MAPK1
SCHEMBL8036362 0.87 LMNA (0.50) MEN1KMT2APOLBLMNAACHE
SCHEMBL25810010 0.86 COMT (0.42) MEN1KMT2APOLBACHETDP1
SCHEMBL25809961 0.86 COMT (0.46) MEN1KMT2APOLBLMNAACHE
SCHEMBL19658348 0.82 PTGS2 (0.46) TDP1HPGDALDH1A1PTGS2MAPK1
SCHEMBL30913227 0.82 PTGS2 (0.46) TDP1HPGDALDH1A1PTGS2MAPK1
SCHEMBL29688196 0.82 LMNA (0.53) MEN1KMT2APOLBLMNAACHE
SCHEMBL3294988 0.82 LMNA (0.53) MEN1KMT2APOLBLMNAACHE
SCHEMBL4392845 0.82 ACHE (0.50) LMNAACHETSHRALOX12TDP1
SCHEMBL19004134 0.82 ACHE (0.50) LMNAACHETSHRALOX12TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3763750-B1 POLYMER, MONOMER, COATING COMPOSITION COMPRISING SAME, AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG CHEMICAL LTD (KR) 2023-07-19 EP disclosed
EP-3366749-B1 COMPOSITION FOR ORGANIC OPTOELECTRONIC ELEMENT, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2021-12-08 EP disclosed
WO-2020253445-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 陕西莱特光电材料股份有限公司 2020-12-24 WO disclosed
WO-2020036459-A1 POLYMER, COATING COMPOSITION COMPRISING SAME, AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-02-20 WO disclosed