SCHEMBL29354583

SCHEMBL29354583

O=C(O)N[C@H]1CCc2c(C(=O)Nc3ccc(F)c(Cl)c3)ccc(F)c21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.50
KMT2A Q03164 6/20 0.49
MEN1 O00255 4/20 0.49
ALDH1A1 P00352 2/20 0.49
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
FADS1 O60427 1/20 0.47
SLC2A1 P11166 1/20 0.45
NR1I2 O75469 1/20 0.43
AHR P35869 1/20 0.43
IDO1 P14902 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 1/20 0.42
MALT1 Q9UDY8 1/20 0.42
PTGS1 P23219 1/20 0.42
TBXAS1 P24557 1/20 0.42
MAPK1 P28482 1/20 0.42
PTGS2 P35354 1/20 0.42

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
SCHEMBL20509670 1.00 NPSR1 (0.50) NPSR1KMT2AMEN1ALDH1A1NPC1
SCHEMBL20509859 1.00 NPSR1 (0.50) NPSR1KMT2AMEN1ALDH1A1NPC1
SCHEMBL29355343 1.00 NPSR1 (0.50) NPSR1KMT2AMEN1ALDH1A1NPC1
Hydrochloric Acid SCHEMBL30644716 0.99 NPSR1 (0.49) NPSR1KMT2AMEN1ALDH1A1NPC1
Hydrochloric Acid SCHEMBL26597491 0.99 NPSR1 (0.49) NPSR1KMT2AMEN1ALDH1A1NPC1
Hydrochloric Acid SCHEMBL20509675 0.99 NPSR1 (0.49) NPSR1KMT2AMEN1ALDH1A1NPC1
SCHEMBL20509792 0.90 KMT2A (0.48) NPSR1KMT2AMEN1ALDH1A1NPC1
SCHEMBL20510063 0.90 KMT2A (0.48) NPSR1KMT2AMEN1ALDH1A1NPC1
SCHEMBL22446049 0.90 NPSR1 (0.45) NPSR1KMT2AMEN1ALDH1A1NPC1
SCHEMBL29656442 0.89 KMT2A (0.52) NPSR1KMT2AMEN1ALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4240369-A1 TARGETED CONJUGATES COMPRISING MODIFIED SIRNA Arbutus Biopharma Corporation (CA) 2023-09-13 EP disclosed
CN-116472063-A Targeted conjugates comprising modified siRNAs 阿布特斯生物制药公司 2023-07-21 CN disclosed
WO-2022098990-A1 TARGETED CONJUGATES COMPRISING MODIFIED SIRNA ARBUTUS BIOPHARMA CORPORATION (CA) 2022-05-12 WO disclosed
EP-3941921-A1 THERAPEUTIC METHODS FOR TREATING HEPATITIS B Arbutus Biopharma Corporation (CA) 2022-01-26 EP disclosed