SCHEMBL25972508

SCHEMBL25972508

c1ccc(-c2ccc(-c3nc(-c4cccc5oc6cc(-c7ccc8cc(-c9ccccc9)ccc8c7)ccc6c45)nc4c3sc3ccccc34)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 1/20 0.36
LIMK1 P53667 3/20 0.34
S1PR5 Q9H228 4/20 0.32
S1PR4 O95977 3/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
ALOX5 P09917 1/20 0.31
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
HCRTR1 O43613 1/20 0.31
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
TERT O14746 1/20 0.30

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
SCHEMBL25972341 1.00 PRKDC (0.36) PRKDCLIMK1S1PR5S1PR4ALDH1A1
SCHEMBL25972490 0.98 PRKDC (0.35) PRKDCLIMK1S1PR5S1PR4ALDH1A1
SCHEMBL25972465 0.98 PRKDC (0.35) PRKDCLIMK1S1PR5S1PR4ALDH1A1
SCHEMBL25972335 0.98 PRKDC (0.35) PRKDCLIMK1S1PR5S1PR4ALDH1A1
SCHEMBL25972796 0.98 PRKDC (0.36) PRKDCLIMK1S1PR5S1PR4ALDH1A1
SCHEMBL25972788 0.98 PRKDC (0.36) PRKDCLIMK1S1PR5S1PR4ALDH1A1
SCHEMBL25972326 0.97 PRKDC (0.35) PRKDCLIMK1S1PR5S1PR4ALDH1A1
SCHEMBL25972346 0.97 PRKDC (0.38) PRKDCLIMK1MAPTALOX5PIM1
SCHEMBL25975915 0.97 PRKDC (0.38) PRKDCLIMK1MAPTALOX5PIM1
SCHEMBL25972622 0.96 PRKDC (0.35) PRKDCLIMK1S1PR5S1PR4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023149718-A1 ORGANIC LIGHT-EMITTING ELEMENT INCLUDING HETEROCYCLIC COMPOUND, COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT-EMITTING ELEMENT, AND METHOD FOR MANUFACTURING ORGANIC LIGHT-EMITTING ELEMENT 엘티소재주식회사 2023-08-10 WO disclosed