Sugi Predict

Sugi Predict / Compounds / SCHEMBL22329623

SCHEMBL22329623

SCHEMBL22329623

c1ccc(-c2ccc3c4ccccc4n(-c4nc(-c5ccccc5)nc(-c5cccc6c5sc5ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cc56)n4)c3c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 2/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ PIM3 Q86V86 3/20 0.33
▸ PIM1 P11309 3/20 0.32
▸ PIM2 Q9P1W9 3/20 0.32
▸ ROCK1 Q13464 1/20 0.30
▸ PRKDC P78527 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
SCHEMBL22701854 0.99 LIMK1 (0.36) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22701865 0.98 LIMK1 (0.35) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22701903 0.96 LIMK1 (0.38) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22701853 0.96 LIMK1 (0.38) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22329624 0.96 ALOX5 (0.38) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22701813 0.95 ALOX5 (0.39) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22701793 0.95 ALOX5 (0.39) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL24301326 0.95 ALOX5 (0.40) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22329622 0.95 ALOX5 (0.38) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22701796 0.94 ALOX5 (0.37) LIMK1ALOX5PIM3PIM1PIM2

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-11581494-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-02-14 — — US disclosed
US-20200259098-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-08-13 — — US disclosed