Sugi Predict

Sugi Predict / Compounds / SCHEMBL25974012

SCHEMBL25974012

SCHEMBL25974012

c1ccc(-c2ccc(-c3cc(-c4nc(-c5ccc6cc(-c7ccccc7)ccc6c5)c5sc6ccccc6c5n4)c4c(c3)oc3ccccc34)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 2/20 0.32
▸ PIM1 P11309 1/20 0.31
▸ PIM3 Q86V86 1/20 0.31
▸ PIM2 Q9P1W9 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
SCHEMBL25974007 0.98 LIMK1 (0.31) LIMK1PIM1PIM3PIM2
SCHEMBL25973918 0.98 LIMK1 (0.31) LIMK1PIM1PIM3PIM2
SCHEMBL25973928 0.98 LIMK1 (0.31) LIMK1PIM1PIM3PIM2TERT
SCHEMBL25974013 0.98 LIMK1 (0.31) LIMK1PIM1PIM3PIM2TERT
SCHEMBL25973923 0.97 S1PR5 (0.31) TNKSTNKS2
SCHEMBL24585568 0.96 S1PR5 (0.32) LIMK1TERT
SCHEMBL25973932 0.96 LIMK1 (0.31) LIMK1PIM1PIM3PIM2
SCHEMBL25973911 0.96 LIMK1 (0.31) LIMK1PIM1PIM3PIM2
SCHEMBL25973924 0.96 NPC1 (0.31) TNKSTNKS2
SCHEMBL25974016 0.95 LIMK1 (0.31) LIMK1PIM1PIM3PIM2

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