SCHEMBL25974007

SCHEMBL25974007

c1ccc(-c2ccc3cc(-c4nc(-c5cc(-c6ccc7ccccc7c6)cc6oc7ccccc7c56)nc5c4sc4ccccc45)ccc3c2)cc1

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.31
S1PR5 Q9H228 2/20 0.31
S1PR4 O95977 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
PIM1 P11309 1/20 0.30
PIM3 Q86V86 1/20 0.30
PIM2 Q9P1W9 1/20 0.30
CYP1A2 P05177 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
TP53 P04637 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
ANO1 Q5XXA6 1/20 0.30
NPC1 O15118 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
RAB9A P51151 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
SCHEMBL25973918 1.00 LIMK1 (0.31) LIMK1S1PR5S1PR4ALDH1A1MAPT
SCHEMBL25973923 0.99 S1PR5 (0.31) S1PR5S1PR4ALDH1A1MAPTCYP1A2
SCHEMBL24585568 0.98 S1PR5 (0.32) LIMK1S1PR5S1PR4ALDH1A1MAPT
SCHEMBL25973932 0.98 LIMK1 (0.31) LIMK1S1PR5S1PR4ALDH1A1MAPT
SCHEMBL25973911 0.98 LIMK1 (0.31) LIMK1S1PR5S1PR4ALDH1A1MAPT
SCHEMBL25973924 0.98 NPC1 (0.31) CYP1A2NPC1CYP2C9CYP2C19RAB9A
SCHEMBL25974012 0.98 LIMK1 (0.32) LIMK1PIM1PIM3PIM2
SCHEMBL25974031 0.97 LIMK1 (0.30) LIMK1S1PR5S1PR4ALDH1A1MAPT
SCHEMBL25973907 0.97 S1PR5 (0.31) S1PR5S1PR4ALDH1A1MAPTCYP1A2
SCHEMBL25973928 0.96 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