SCHEMBL29319315

SCHEMBL29319315

Cc1ccc2c(c1)nc(-c1ccccc1)n2-c1ccc2cc(-c3c4ccccc4c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccccc34)ccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.38
SIRT1 Q96EB6 1/20 0.38
ALDH1A1 P00352 8/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
POLB P06746 1/20 0.36
DHFR P00374 2/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
PTGER4 P35408 1/20 0.34
PDE10A Q9Y233 2/20 0.33
MAPK10 P53779 1/20 0.33
MDM2 Q00987 1/20 0.32
MEN1 O00255 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
SCHEMBL29319298 0.93 SIRT2 (0.41) NLRP3SIRT2SIRT1ALDH1A1LMNA
SCHEMBL29319309 0.93 ESR1 (0.43) ALDH1A1LMNAGAARAB9ANPSR1
SCHEMBL29319312 0.88 PDE10A (0.37) NLRP3PDE10A
SCHEMBL26344670 0.87 MAPK10 (0.41) ALDH1A1LMNAGAARAB9ANPSR1
SCHEMBL29319623 0.86 NLRP3 (0.48) NLRP3SIRT2SIRT1ALDH1A1LMNA
SCHEMBL21392554 0.85 ESR1 (0.48) SIRT2SIRT1ALDH1A1RAB9ANPSR1
SCHEMBL26343705 0.85 ESR1 (0.42) SIRT2SIRT1ALDH1A1LMNAGAA
SCHEMBL13487798 0.83 SIRT2 (0.39) SIRT2SIRT1ALDH1A1LMNAGAA
SCHEMBL18925702 0.83 PTGER4 (0.40) SIRT2SIRT1ALDH1A1LMNAGAA
SCHEMBL18999488 0.83 PTGER4 (0.40) SIRT2SIRT1ALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240244970-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2024-07-18 US disclosed
US-20240244970-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2024-07-18 US disclosed