SCHEMBL21119944

SCHEMBL21119944

c1ccc(-c2ccc3ccc4ccc(-c5cccc6c(-c7ccc8c(ccc9c%10ccccc%10sc89)c7)cccc56)nc4c3n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
F9 P00740 1/20 0.38
CYP1A1 P04798 2/20 0.36
CYP1B1 Q16678 2/20 0.36
S1PR5 Q9H228 7/20 0.35
S1PR4 O95977 6/20 0.35
PRKDC P78527 1/20 0.34
LIMK1 P53667 2/20 0.34
PARP1 P09874 1/20 0.34
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
CYP1A2 P05177 1/20 0.33
MAPT P10636 1/20 0.33
CLK2 P49760 1/20 0.32
HIPK1 Q86Z02 1/20 0.32
DYRK2 Q92630 1/20 0.32
HIPK2 Q9H2X6 1/20 0.32
HIPK3 Q9H422 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
SCHEMBL21119854 0.97 ALOX5 (0.39) ALOX5F9CYP1A1CYP1B1S1PR5
SCHEMBL21119598 0.92 ALOX5 (0.39) ALOX5F9CYP1A1CYP1B1S1PR5
SCHEMBL20042384 0.90 ALOX5 (0.50) ALOX5F9S1PR5S1PR4PRKDC
SCHEMBL21119688 0.89 LIMK1 (0.40) ALOX5F9CYP1A1CYP1B1LIMK1
SCHEMBL21119914 0.89 ALOX5 (0.42) ALOX5CYP1A1CYP1B1S1PR5S1PR4
SCHEMBL21119860 0.87 ALOX5 (0.38) ALOX5F9CYP1A1CYP1B1LIMK1
SCHEMBL15582066 0.87 ALOX5 (0.52) ALOX5CYP1A1CYP1B1S1PR5S1PR4
SCHEMBL21119799 0.85 F9 (0.38) ALOX5F9S1PR5S1PR4LIMK1
SCHEMBL21120229 0.85 ALOX5 (0.38) ALOX5LIMK1MAPTCLK2HIPK1
SCHEMBL21119604 0.85 LIMK1 (0.34) ALOX5CYP1A1CYP1B1LIMK1PARP1

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-11522139-B2 Organic light emitting diode LG DISPLAY CO., LTD. (KR) 2022-12-06 US disclosed
US-20190207123-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2019-07-04 US disclosed