SCHEMBL7938747

SCHEMBL7938747

CCOC(=O)c1cn(N(C)C)c2ccccc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.52
MAOB P27338 1/20 0.50
TSHR P16473 1/20 0.47
PKM P14618 1/20 0.47
LMNA P02545 1/20 0.47
KDM4E B2RXH2 8/20 0.46
ALDH1A1 P00352 5/20 0.46
GAA P10253 2/20 0.46
HPGD P15428 2/20 0.46
CLEC4M Q9H2X3 1/20 0.46
GLA P06280 1/20 0.46
PIM1 P11309 1/20 0.46
IRAK1 P51617 1/20 0.46
CAMK2B Q13554 1/20 0.46
CAMK2G Q13555 1/20 0.46
CAMK2D Q13557 1/20 0.46
PIM3 Q86V86 1/20 0.46
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MEN1 O00255 1/20 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
SCHEMBL3296347 0.84 PIM1 (0.53) TDP1MAOBPKMLMNAKDM4E
SCHEMBL3294927 0.83 LMNA (0.52) TDP1TSHRLMNAKDM4EALDH1A1
SCHEMBL3296359 0.83 LMNA (0.52) TDP1TSHRLMNAKDM4EALDH1A1
SCHEMBL15071685 0.82 ALDH1A1 (0.57) TDP1MAOBTSHRPKMLMNA
SCHEMBL7056985 0.81 LMNA (0.69) TDP1MAOBTSHRLMNAKDM4E
SCHEMBL6681662 0.81 TDP1 (0.54) TDP1MAOBTSHRPKMLMNA
SCHEMBL10864501 0.80 LMNA (0.55) LMNAKDM4EALDH1A1GLA
SCHEMBL7941010 0.80 TDP1 (0.53) TDP1MAOBTSHRPKMLMNA
SCHEMBL5101006 0.79 NR4A2 (0.59) TDP1MAOBTSHRPKMLMNA
SCHEMBL3291681 0.78 LMNA (0.47) TDP1TSHRLMNAKDM4EALDH1A1

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
CN-1161336-C Quinoline carboxamides as antiviral agents �������Ŷ���Լ��������˾ 2004-08-11 CN disclosed
CN-1333753-A Quinoline carboxamides as antiviral agents UPJOHN CO (US) 2002-01-30 CN disclosed
US-6248739-B1 DNA POLYMERASE INHIBITORS EFFECTIVE AGAINST HERPESVIRUSES PHARMACIA & UPJOHN COMPANY 2001-06-19 US disclosed