SCHEMBL24529200

SCHEMBL24529200

CCN[C@H](C)c1ccc(OC)c(-c2ccc3nccn3c2)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TRIM33 Q9UPN9 4/20 0.41
▸ AXL P30530 2/20 0.40
▸ FLT3 P36888 2/20 0.40
▸ MERTK Q12866 2/20 0.40
▸ GRM2 Q14416 1/20 0.38
▸ DYRK1A Q13627 2/20 0.38
▸ CASR P41180 4/20 0.38
▸ TGFBR1 P36897 3/20 0.37
▸ PDE4A P27815 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ PMP22 Q01453 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ NAMPT P43490 1/20 0.35

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
SCHEMBL24529175 0.86 TRIM33 (0.39) TRIM33AXLFLT3MERTKGRM2
SCHEMBL27181397 0.86 TRIM33 (0.39) TRIM33AXLFLT3MERTKGRM2
SCHEMBL3920300 0.81 CASR (0.59) TRIM33AXLFLT3MERTKCASR
SCHEMBL24529531 0.79 HCRTR2 (0.52) AXLFLT3MERTKDYRK1ATGFBR1
SCHEMBL27179772 0.79 HCRTR2 (0.52) AXLFLT3MERTKDYRK1ATGFBR1
SCHEMBL24529202 0.78 TRIM33 (0.46) TRIM33AXLFLT3MERTKDYRK1A
SCHEMBL3920376 0.73 TRIM33 (0.44) TRIM33AXLFLT3MERTKCASR
SCHEMBL27181434 0.72 SYK (0.39) CASR
SCHEMBL24529318 0.72 SYK (0.39) CASR
SCHEMBL31380975 0.71 ALDH1A3 (0.56) TRIM33AXLFLT3MERTKDYRK1A

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-2022132696-A1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-06-23 — — WO disclosed
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