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SCHEMBL22238237

SCHEMBL22238237

NCCCCC(NC(=O)COCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCn1cc(CNC(=O)C2CCCCC2)nn1)C(=O)Nc1ccc(COC(=O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.41
▸ DGAT1 O75907 4/20 0.39
▸ F2RL1 P55085 1/20 0.37
▸ F2R P25116 1/20 0.35
▸ KLKB1 P03952 1/20 0.35
▸ PLG P00747 1/20 0.35
▸ GRIN1 Q05586 1/20 0.35
▸ GRIN2A Q12879 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.34
▸ NPY1R P25929 1/20 0.33
▸ TTR P02766 1/20 0.33
▸ IL2 P60568 1/20 0.33

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
SCHEMBL20016562 0.85 TTR (0.45) FOLH1DGAT1F2RL1F2RKLKB1
SCHEMBL24335147 0.84 TTR (0.43) FOLH1DGAT1F2RL1F2RKLKB1
SCHEMBL22969740 0.84 TTR (0.38) FOLH1DGAT1F2RL1F2RKLKB1
SCHEMBL29351004 0.84 TTR (0.46) FOLH1DGAT1F2RL1F2RKLKB1
SCHEMBL26412265 0.83 TTR (0.42) FOLH1F2RL1F2RKLKB1PLG
SCHEMBL23180460 0.83 TTR (0.37) FOLH1DGAT1F2RL1F2RKLKB1
SCHEMBL24176337 0.82 TTR (0.37) FOLH1F2RL1F2RKLKB1PLG
SCHEMBL25204552 0.81 TTR (0.46) FOLH1DGAT1F2RL1F2RKLKB1
SCHEMBL25100412 0.81 FOLH1 (0.39) FOLH1DGAT1NPY1R
SCHEMBL12342504 0.80 TTR (0.44) FOLH1F2RKLKB1PLGTTR

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
EP-3024460-B1 METHOD FOR PRODUCING ANTIBODY-SN-38 IMMUNOCONJUGATES WITH A CL2A LINKER IMMUNOMEDICS INC (US) 2020-07-22 — — EP disclosed
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