SCHEMBL6579559

SCHEMBL6579559

CCCCCCOCC(=O)N(C)c1cc(NC(C)=O)ccc1C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.42
RECQL P46063 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
MMP13 P45452 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
KMT2A Q03164 3/20 0.39
TSHR P16473 3/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
NPC1 O15118 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.37
CES2 O00748 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL6579888 1.00 HPGD (0.42) HPGDRECQLTDP1MMP13SMN1; SMN2
SCHEMBL6581702 0.96 HPGD (0.46) HPGDRECQLTDP1MMP13SMN1; SMN2
SCHEMBL6579513 0.93 TDP1 (0.49) HPGDRECQLTDP1SMN1; SMN2KMT2A
SCHEMBL6576914 0.92 TDP1 (0.44) HPGDRECQLTDP1MMP13SMN1; SMN2
SCHEMBL6577324 0.88 KMT2A (0.39) HPGDRECQLTDP1MMP13SMN1; SMN2
SCHEMBL6579475 0.88 LMNA (0.41) HPGDTDP1SMN1; SMN2TSHRALDH1A1
SCHEMBL6579935 0.88 LMNA (0.41) HPGDTDP1SMN1; SMN2TSHRALDH1A1
SCHEMBL6579402 0.88 SMN1; SMN2 (0.48) HPGDSMN1; SMN2KMT2ATSHRALDH1A1
SCHEMBL6579930 0.86 TDP1 (0.41) HPGDRECQLTDP1MMP13SMN1; SMN2
SCHEMBL6582112 0.86 LMNA (0.41) HPGDTDP1SMN1; SMN2TSHRALDH1A1

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-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed