SCHEMBL12322169

SCHEMBL12322169

c1ccc(N(c2ccccc2)c2ccc(-c3c4ccccc4c(N(c4ccccc4)c4ccc5c(-c6ccc7ccccc7c6)c6ccccc6c(-c6ccc7ccccc7c6)c5c4)c4ccccc34)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 4/20 0.34
▸ ESR2 Q92731 4/20 0.34
▸ GPR84 Q9NQS5 1/20 0.33
▸ ACMSD Q8TDX5 1/20 0.33
▸ CYP1A1 P04798 2/20 0.32
▸ CYP1B1 Q16678 2/20 0.32
▸ PDE9A O76083 1/20 0.32
▸ ALOX5 P09917 2/20 0.32
▸ GSTP1 P09211 1/20 0.32
▸ CYP1A2 P05177 3/20 0.31
▸ CYP2C9 P11712 3/20 0.31
▸ CYP2C19 P33261 3/20 0.31
▸ CYP3A4 P08684 2/20 0.31
▸ CYP2D6 P10635 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ IKBKB O14920 1/20 0.31

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
SCHEMBL12323512 0.97 GPR84 (0.35) ESR1ESR2GPR84ACMSDCYP1A1
SCHEMBL12323516 0.97 GPR84 (0.35) ESR1ESR2GPR84ACMSDCYP1A1
SCHEMBL14099750 0.96 ACMSD (0.33) ESR1ESR2GPR84ACMSDCYP1A1
SCHEMBL12323517 0.95 ESR1 (0.35) ESR1ESR2GPR84ACMSDCYP1A1
SCHEMBL12323507 0.94 ESR1 (0.37) ESR1ESR2GPR84ACMSDCYP1A1
SCHEMBL8406128 0.93 GPR84 (0.37) ESR1ESR2GPR84ACMSDCYP1A1
SCHEMBL12928339 0.93 GPR84 (0.37) ESR1ESR2GPR84ACMSDCYP1A1
SCHEMBL12322170 0.92 TDP1 (0.36) CYP1A2CYP2C9CYP2C19CYP3A4ALDH1A1
SCHEMBL12928333 0.92 ESR1 (0.37) ESR1ESR2GPR84ACMSDCYP1A1
SCHEMBL13405626 0.92 GPR84 (0.36) ESR1ESR2GPR84ACMSDCYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2364964-A1 Novel anthracene derivative and organic electronic device using the same LG Chem, Ltd. (KR) 2011-09-14 — — EP disclosed
US-7965032-B2 Anthracene derivative and organic electronic device using the same LG CHEM, LTD. (KR) 2011-06-21 — — US disclosed
US-7965032-B2 Anthracene derivative and organic electronic device using the same LG CHEM, LTD. (KR) 2011-06-21 — — US disclosed
US-20070205412-A1 Novel anthracene derivative and organic electronic device using the same LG CHEM, LTD. (KR) 2007-09-06 — — US disclosed
US-20070205412-A1 Novel anthracene derivative and organic electronic device using the same LG CHEM, LTD. (KR) 2007-09-06 — — US disclosed
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