SCHEMBL22360665

SCHEMBL22360665

C(=C(/Cc1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1)c1cccc2ccccc12)\c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.38
SIGMAR1 Q99720 4/20 0.37
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTGS1 P23219 2/20 0.32
ABCC4 O15439 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
NR4A1 P22736 1/20 0.32
NR4A2 P43354 1/20 0.32

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
SCHEMBL13016389 0.96 SIGMAR1 (0.39) NR1H4SIGMAR1CYP1A2CYP3A4CYP2D6
SCHEMBL12982970 0.96 SIGMAR1 (0.39) NR1H4SIGMAR1CYP1A2CYP3A4CYP2D6
SCHEMBL19831771 0.86 HPGD (0.33) NR1H4SIGMAR1L3MBTL1HPGDKDM4E
SCHEMBL22422887 0.81 RXRA (0.33) CYP1A2L3MBTL1KDM4EALDH1A1PTGS1
SCHEMBL25681190 0.80 SIGMAR1 (0.34) NR1H4SIGMAR1L3MBTL1KDM4EPTGS1
SCHEMBL25056932 0.80 LTB4R2 (0.40) PTGS1ABCC4LMNAGAATSHR
SCHEMBL19784598 0.78 SIGMAR1 (0.37) SIGMAR1L3MBTL1HPGDKDM4EALDH1A1
SCHEMBL20345317 0.78 ACP3 (0.36) NR1H4SIGMAR1L3MBTL1HPGDKDM4E
SCHEMBL15788739 0.77 SIGMAR1 (0.42) SIGMAR1L3MBTL1PTGS1ABCC4LMNA
SCHEMBL12951308 0.76 SIGMAR1 (0.41) SIGMAR1L3MBTL1ACP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023113124-A1 ORGANIC LIGHT-EMITTING DIODE AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 엘지디스플레이 주식회사 2023-06-22 WO disclosed
WO-2021135542-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2021-07-08 WO disclosed
WO-2020166825-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2020-08-20 WO disclosed