SCHEMBL4979894

SCHEMBL4979894

Cc1ccc(C(=O)NCC(O)CO)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
POLB P06746 1/20 0.53
ALDH1A1 P00352 3/20 0.51
HPGD P15428 3/20 0.51
KDM4E B2RXH2 1/20 0.51
MMP13 P45452 1/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
NPC1 O15118 5/20 0.47
RAB9A P51151 4/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
MEN1 O00255 1/20 0.46
ICAM1 P05362 1/20 0.46
SELE P16581 1/20 0.46
MAPT P10636 1/20 0.45

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
SCHEMBL12301897 1.00 LMNA (0.53) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL13157814 1.00 LMNA (0.53) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL24386514 0.86 LMNA (0.53) LMNAPOLBALDH1A1HPGDMMP13
SCHEMBL10195595 0.86 LMNA (0.53) LMNAPOLBALDH1A1HPGDMMP13
SCHEMBL14459751 0.83 PLK1 (0.54) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL12376591 0.83 EPHX2 (0.55) LMNAALDH1A1HPGDKDM4EL3MBTL1
SCHEMBL28463256 0.83 OGG1 (0.52) ALDH1A1HPGDKDM4EHDAC1NPC1
SCHEMBL9781002 0.83 PRMT5 (0.52) ALDH1A1HPGDKDM4ENPC1RAB9A
SCHEMBL24227433 0.83 PRMT5 (0.57) LMNAALDH1A1HPGDKDM4EL3MBTL1
SCHEMBL22640849 0.83 KDM4E (0.48) LMNAPOLBALDH1A1HPGDKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1987022-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES Pfizer Products Inc. (US) 2008-11-05 EP claimed
WO-2007091176-A1 PYRIDINONE PYRAZOLE UREA AND PYRIMIDINONE PYRAZOLE UREA DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-08-16 WO claimed
US-8367668-B2 Pyridazinone derivatives MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2013-02-05 US disclosed
US-8367668-B2 Pyridazinone derivatives MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2013-02-05 US disclosed