SCHEMBL8998079

SCHEMBL8998079

C=C(C)COC(=O)Nc1cc(OC(=O)Oc2cc(NC(=O)OCC(=C)C)c(F)cc2Cl)c(Cl)cc1F

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.35
POLB P06746 1/20 0.34
TP53 P04637 1/20 0.34
DHODH Q02127 1/20 0.33
EGFR P00533 1/20 0.33
KDR P35968 1/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.33
RORC P51449 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL9407131 0.85 ALDH1A1 (0.48) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL9427678 0.82 ALDH1A1 (0.52) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL8760807 0.82 POLB (0.43) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL9426916 0.81 MEN1 (0.52) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL9407130 0.81 L3MBTL1 (0.62) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL8998085 0.80 LMNA (0.38) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL8083816 0.80 ALDH1A1 (0.46) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL9427481 0.80 LMNA (0.39) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL9427488 0.80 LMNA (0.39) LMNANPSR1ALDH1A1TSHRL3MBTL1
SCHEMBL8998058 0.79 LMNA (0.34) LMNANPSR1ALDH1A1TSHRL3MBTL1

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-0496347-B1 Methods of preparing fluorobenzene derivatives and related compounds SAGAMI CHEM RES (JP) 1996-09-04 EP disclosed
US-5391807-A Methods of preparing fluorobenzene derivatives and related compounds SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-02-21 US disclosed
EP-0496347-A2 Methods of preparing fluorobenzene derivatives and related compounds SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-29 EP disclosed