SCHEMBL7938481

SCHEMBL7938481

C=CCOn1cc(C(=O)OCC)c(=O)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
TDP1 Q9NUW8 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 2/20 0.47
MAOB P27338 1/20 0.45
PKM P14618 1/20 0.43
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 5/20 0.43
HPGD P15428 3/20 0.43
TSHR P16473 2/20 0.43
MEN1 O00255 2/20 0.43
USP2 O75604 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP3A4 P08684 1/20 0.43
PIM1 P11309 1/20 0.42
IRAK1 P51617 1/20 0.42
CAMK2B Q13554 1/20 0.42
CAMK2G Q13555 1/20 0.42
CAMK2D Q13557 1/20 0.42

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
SCHEMBL7941010 0.83 TDP1 (0.53) KMT2ATDP1LMNAMAOBPKM
SCHEMBL18833437 0.82 KMT2A (0.69) KMT2ATDP1SMN1; SMN2LMNAMAOB
SCHEMBL15071685 0.77 ALDH1A1 (0.57) KMT2ATDP1LMNAMAOBPKM
SCHEMBL6681662 0.76 TDP1 (0.54) KMT2ATDP1LMNAMAOBPKM
SCHEMBL7056985 0.76 LMNA (0.69) KMT2ATDP1SMN1; SMN2LMNAMAOB
SCHEMBL23914948 0.76 KMT2A (0.60) KMT2ATDP1LMNAALDH1A1KDM4E
SCHEMBL27691191 0.76 CYP3A4 (0.54) KMT2ATDP1SMN1; SMN2LMNAPKM
SCHEMBL15956289 0.75 LMNA (0.70) LMNAALDH1A1
SCHEMBL7938747 0.74 TDP1 (0.52) KMT2ATDP1LMNAMAOBPKM
SCHEMBL5101006 0.74 NR4A2 (0.59) TDP1LMNAMAOBPKMALDH1A1

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