SCHEMBL17384693

SCHEMBL17384693

CCOC(=O)c1cnc2cc3c(cc2c1)OCO3

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAOB P27338 5/20 0.51
SIRT2 Q8IXJ6 2/20 0.49
SIRT1 Q96EB6 2/20 0.49
SIRT3 Q9NTG7 1/20 0.49
OGA O60502 2/20 0.48
MAPT P10636 4/20 0.48
RAB9A P51151 3/20 0.48
TSHR P16473 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
HSD17B10 Q99714 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 3/20 0.47
RXFP1 Q9HBX9 1/20 0.47
PDGFRB P09619 1/20 0.47
PDGFRA P16234 1/20 0.47
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46

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
SCHEMBL18987868 0.92 MAOB (0.51) LMNAMAOBMAPTRAB9ATSHR
SCHEMBL20799483 0.85 ALDH1A1 (0.50) LMNATDP1MAPTRAB9ATSHR
SCHEMBL20799494 0.82 L3MBTL1 (0.47) LMNATDP1OGAMAPTRAB9A
SCHEMBL20799489 0.81 ALDH1A1 (0.53) LMNATDP1MAPTRAB9AL3MBTL1
SCHEMBL20799492 0.80 MAOB (0.47) LMNAMAOBMAPTRAB9ATSHR
SCHEMBL4027801 0.79 RAB9A (0.57) LMNASIRT2SIRT1SIRT3OGA
SCHEMBL7227312 0.79 MAOB (0.54) LMNAMAOBMAPTRAB9ATSHR
SCHEMBL5553780 0.78 MGAM (0.51) LMNATDP1MAPTRAB9AL3MBTL1
SCHEMBL20474252 0.78 PDGFRB (0.73) MAOBMAPTRAB9ANPC1PDGFRB
SCHEMBL6862895 0.77 LMNA (0.54) LMNATDP1SIRT2SIRT1SIRT3

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
WO-2015198349-A1 A ONE POT SYNTHESIS OF 3-SUBSTITUTED QUINOLINE CARBOXYLATES AND ITS DERIVATIVES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-12-30 WO disclosed