SCHEMBL21119799

SCHEMBL21119799

c1ccc(-c2ccc3ccc4ccc(-c5cccc6c(-c7ccc8c(ccc9sc%10ccccc%10c98)c7)cccc56)nc4c3n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F9 P00740 2/20 0.38
S1PR5 Q9H228 8/20 0.35
S1PR4 O95977 6/20 0.35
LIMK1 P53667 2/20 0.33
PARP1 P09874 1/20 0.33
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
ALOX5 P09917 1/20 0.33
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
CDK1 P06493 1/20 0.31
MAPKAPK2 P49137 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
SCHEMBL21119620 0.97 F9 (0.33) F9S1PR5S1PR4LIMK1PARP1
SCHEMBL21119895 0.93 S1PR5 (0.33) F9S1PR5S1PR4PARP1KDM4E
SCHEMBL21119608 0.90 F9 (0.36) F9LIMK1PARP1PIM1PIM2
SCHEMBL21119589 0.89 ERN1 (0.37) F9S1PR5S1PR4ALOX5KDM4E
SCHEMBL21119641 0.87 CDK1 (0.40) F9LIMK1PARP1PIM1PIM2
SCHEMBL21119842 0.86 CCR1 (0.35) KDM4EALDH1A1MAPT
SCHEMBL21119630 0.85 LIMK1 (0.32) LIMK1PARP1MAPTCDK1MAPKAPK2
SCHEMBL21119944 0.85 ALOX5 (0.43) F9S1PR5S1PR4LIMK1PARP1
SCHEMBL21120247 0.84 CDK1 (0.41) LIMK1PARP1KDM4EALDH1A1MAPT
SCHEMBL15582072 0.83 PIM3 (0.36) F9S1PR5S1PR4LIMK1PARP1

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