SCHEMBL22989142

SCHEMBL22989142

c1ccc(-c2nc(-c3ccc(-n4c5ccc6cccc7oc8cccc9ccc4c(c98)c5c67)c4ccccc34)cc3ccccc23)cc1

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
CYP1A1 P04798 1/20 0.30
CYP1A2 P05177 1/20 0.30
FYN P06241 1/20 0.30
MAPK3 P27361 1/20 0.30
AHR P35869 1/20 0.30
PAX8 Q06710 1/20 0.30
ABCG2 Q9UNQ0 1/20 0.30

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
SCHEMBL22989053 0.86 CYP1A1 (0.32) L3MBTL1KDM4EALDH1A1LMNACYP1A1
SCHEMBL22988952 0.84 HPGD (0.36) KDM4EALDH1A1LMNAHPGDCYP1A1
SCHEMBL22989149 0.83 MEN1 (0.38) L3MBTL1KDM4EALDH1A1LMNAHPGD
SCHEMBL22989157 0.81 MEN1 (0.39) L3MBTL1KDM4EALDH1A1LMNAHPGD
SCHEMBL22989005 0.81 KDM4E (0.36) L3MBTL1KDM4EALDH1A1LMNAHPGD
SCHEMBL22989151 0.80 MEN1 (0.33) L3MBTL1KDM4EALDH1A1LMNAHPGD
SCHEMBL22989012 0.79 L3MBTL1 (0.34) L3MBTL1KDM4EALDH1A1LMNACYP1A2
SCHEMBL22989238 0.78 TSHR (0.38) KDM4EALDH1A1LMNAHPGDCYP1A2
SCHEMBL22989219 0.78 KDM4E (0.40) L3MBTL1KDM4EALDH1A1LMNACYP1A2
SCHEMBL22988985 0.78 ALDH1A1 (0.34) L3MBTL1KDM4EALDH1A1LMNAHPGD

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
WO-2021029757-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-02-18 WO disclosed