SCHEMBL1573349

SCHEMBL1573349

Cc1c(NC(=O)c2cccc(OCCOS(C)(=O)=O)c2)c2ccccn2c1C(=O)c1ccc(N)c(C(=O)O)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
AKR1C2 P52895 2/20 0.36
AKR1C1 Q04828 2/20 0.36
HTT P42858 1/20 0.35
NR1H4 Q96RI1 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 2/20 0.34
KAT6A Q92794 2/20 0.34

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
SCHEMBL4512025 0.93 ALDH1A1 (0.37) ALDH1A1HTTMEN1KMT2AHPGD
SCHEMBL4518702 0.92 MEN1 (0.38) ALDH1A1AKR1C2AKR1C1HTTNR1H4
SCHEMBL1573171 0.91 NR1H4 (0.42) ALDH1A1AKR1C2AKR1C1NR1H4MEN1
SCHEMBL1573416 0.90 ALDH1A1 (0.38) ALDH1A1AKR1C2AKR1C1HTTNR1H4
SCHEMBL1573017 0.88 F10 (0.39) ALDH1A1AKR1C2AKR1C1NR1H4MEN1
SCHEMBL13918726 0.87 F10 (0.38) ALDH1A1AKR1C2AKR1C1NR1H4MEN1
SCHEMBL4522090 0.87 LMNA (0.39) ALDH1A1AKR1C2AKR1C1HTTMEN1
SCHEMBL13918698 0.87 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AHPGDNPSR1
SCHEMBL1572822 0.87 F10 (0.38) ALDH1A1AKR1C2AKR1C1NR1H4MEN1
SCHEMBL150004 0.86 MAPT (0.46) ALDH1A1MEN1KMT2AHPGDNPSR1

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
EP-2018165-B1 FGF-PECEPTOR AGONIST DIMERIC COMPOUNDS SANOFI AVENTIS (FR) 2011-04-13 EP disclosed
EP-2018165-A1 FGF-PECEPTOR AGONIST DIMERIC COMPOUNDS Sanofi-Aventis (FR) 2009-01-28 EP disclosed
WO-2007080325-A1 FGF-RECEPTOR AGONIST DIMERIC COMPOUNDS SANOFI-AVENTIS (FR) 2007-07-19 WO disclosed