SCHEMBL24529202

SCHEMBL24529202

CCNCc1ccc(OC)c(-c2ccc3nccn3c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRIM33 Q9UPN9 4/20 0.46
▸ AXL P30530 2/20 0.46
▸ FLT3 P36888 2/20 0.46
▸ MERTK Q12866 2/20 0.46
▸ HTR1A P08908 1/20 0.45
▸ HTR1D P28221 1/20 0.45
▸ HTR1B P28222 1/20 0.45
▸ HTR2A P28223 1/20 0.45
▸ HTR2C P28335 1/20 0.45
▸ HTR7 P34969 1/20 0.45
▸ HTR2B P41595 1/20 0.45
▸ HTR5A P47898 1/20 0.45
▸ HTR6 P50406 1/20 0.45
▸ NAMPT P43490 3/20 0.41
▸ DYRK1A Q13627 2/20 0.39
▸ KEAP1 Q14145 1/20 0.39
▸ TGFBR1 P36897 1/20 0.38
▸ RET P07949 1/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ PDE3A Q14432 1/20 0.38

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
SCHEMBL24529150 0.84 HTR7 (0.45) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL3920300 0.81 CASR (0.59) TRIM33AXLFLT3MERTKRET
SCHEMBL24529200 0.78 TRIM33 (0.41) TRIM33AXLFLT3MERTKNAMPT
SCHEMBL24529535 0.78 DYRK1A (0.47) AXLFLT3MERTKDYRK1AKEAP1
SCHEMBL21099155 0.78 KEAP1 (0.58) AXLFLT3MERTKNAMPTDYRK1A
SCHEMBL3920376 0.76 TRIM33 (0.44) TRIM33AXLFLT3MERTKNAMPT
SCHEMBL24529175 0.75 TRIM33 (0.39) TRIM33AXLFLT3MERTKDYRK1A
SCHEMBL27181397 0.75 TRIM33 (0.39) TRIM33AXLFLT3MERTKDYRK1A
SCHEMBL31380975 0.73 ALDH1A3 (0.56) TRIM33AXLFLT3MERTKNAMPT
SCHEMBL24529319 0.71 SYK (0.40) HTR1AHTR1DHTR1BHTR2AHTR2C

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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