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SCHEMBL6078993

SCHEMBL6078993

COC(=O)c1cc(S(=O)(=O)Nc2ccc3ccc(NC(=NC#N)Nc4ccc5ccc(NS(=O)(=O)c6ccc(Cl)c(C(=O)OC)c6)cc5c4)cc3c2)ccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.55
▸ LMNA P02545 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ PLAU P00749 3/20 0.46
▸ MAPT P10636 1/20 0.43
▸ TSHR P16473 1/20 0.42
▸ PLA2G7 Q13093 2/20 0.41

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
SCHEMBL6079332 0.89 KMT2A (0.53) ALDH1A1LMNAGAA
SCHEMBL6079065 0.88 ALDH1A1 (0.59) ALDH1A1LMNAGAAL3MBTL1PLAU
SCHEMBL6078277 0.84 LMNA (0.67) ALDH1A1LMNAGAAL3MBTL1PLAU
SCHEMBL6078321 0.82 ALDH1A1 (0.52) ALDH1A1LMNAGAAL3MBTL1PLAU
SCHEMBL6079143 0.82 ALDH1A1 (0.64) ALDH1A1LMNAGAAL3MBTL1PLAU
SCHEMBL6078676 0.82 LMNA (0.64) ALDH1A1LMNAGAAL3MBTL1PLAU
SCHEMBL6429403 0.80 LMNA (0.62) ALDH1A1LMNAGAAL3MBTL1MAPT
SCHEMBL6079643 0.79 ALDH1A1 (0.65) ALDH1A1LMNAGAAL3MBTL1PLAU
SCHEMBL6077582 0.79 ALDH1A1 (0.52) ALDH1A1LMNAGAAL3MBTL1PLAU
SCHEMBL6078213 0.78 ALDH1A1 (0.59) ALDH1A1LMNAGAAL3MBTL1PLAU

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
US-7071231-B2 Naphthalene ureas as glucose uptake enhancers TELIK, INC. (US) 2006-07-04 — — US disclosed