SCHEMBL6363263

SCHEMBL6363263

CN(Cc1c2ccccc2c(CN(C)C(=O)c2ccc(Oc3ccc(C(=O)N(C)Cc4c5ccccc5c(CNCC(=O)OC(C)(C)C)c5ccccc45)cc3)cc2)c2ccccc12)C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ ATM Q13315 1/20 0.43
▸ MMP13 P45452 2/20 0.37
▸ MCHR1 Q99705 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PTPRC P08575 2/20 0.34
▸ GBA1 P04062 1/20 0.34
▸ HDAC3 O15379 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ NCOR2 Q9Y618 1/20 0.33
▸ LTA4H P09960 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
SCHEMBL6363259 0.92 MEN1 (0.43) MEN1KMT2AATMMMP13MCHR1
SCHEMBL6363266 0.89 MEN1 (0.53) MEN1KMT2AATMMMP13MCHR1
SCHEMBL6364351 0.86 GBA1 (0.34) MEN1KMT2AALDH1A1PTPRCGBA1
SCHEMBL6369120 0.84 KMT2A (0.37) MEN1KMT2AALDH1A1PTPRCGBA1
SCHEMBL6363365 0.83 KMT2A (0.38) MEN1KMT2AATMALDH1A1HPGD
SCHEMBL6363912 0.82 BCHE (0.34) KMT2APTPRCGBA1
SCHEMBL6368947 0.82 KMT2A (0.35) MEN1KMT2APTPRCGBA1
SCHEMBL6363734 0.81 KMT2A (0.35) MEN1KMT2APTPRCGBA1
SCHEMBL6369123 0.81 ACHE (0.38) GBA1HDAC1HDAC2
SCHEMBL6363322 0.81 ACHE (0.38) GBA1HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6916660-B2 Fluorescent sensor compounds for detecting saccharides NORTH CAROLINA STATE UNIVERSITY (US) 2005-07-12 — — US disclosed
US-20040048390-A1 Fluorescent sensor compounds for detecting saccharides NORTH CAROLINA STATE UNIVERSITY 2004-03-11 — — US disclosed
WO-2003094926-A1 FLUORESCENT SENSOR COMPOUNDS FOR DETECTING SACCHARIDES NORTH CAROLINA STATE UNIVERSITY (US) 2003-11-20 — — WO disclosed
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