SCHEMBL7517882

SCHEMBL7517882

C=C(c1ccccc1F)c1nc2ccsc2c(=O)n1-c1cccnc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
ALDH1A1 P00352 7/20 0.39
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
PDE4B Q07343 1/20 0.36
PDE7A Q13946 1/20 0.36
PIK3CD O00329 3/20 0.35
LMNA P02545 1/20 0.34
HSP90AA1 P07900 1/20 0.34

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
SCHEMBL7521413 0.90 POLB (0.42) POLBALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7558093 0.86 ALDH1A1 (0.42) POLBALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7512782 0.83 ALDH1A1 (0.41) POLBALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7510642 0.79 POLB (0.46) POLBALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7512387 0.78 ALDH1A1 (0.42) POLBALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7515627 0.77 ALDH1A1 (0.42) POLBALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7518257 0.76 POLB (0.43) POLBALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL6221006 0.76 POLB (0.61) POLBALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL7517887 0.76 KMT2A (0.52) POLBALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL7514703 0.76 ALDH1A1 (0.44) POLBALDH1A1MAPTSMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807633-B1 Novel 2,3-disubstituted-(5,6)- heteroarylfused-pyrimidine-4-ones PFIZER (US) 2002-11-06 EP disclosed
EP-0807633-A2 Novel 2,3-disubstituted-(5,6)- heteroarylfused-pyrimidine-4-ones PFIZER INC. (US) 1997-11-19 EP disclosed