SCHEMBL4784933

SCHEMBL4784933

O=S(=O)(Oc1ccccc1-c1c[nH]cn1)c1ccc2c(c1)CCC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
ENPP2 Q13822 1/20 0.36
PTGES2 Q9H7Z7 2/20 0.34
HTR2C P28335 7/20 0.34
HTR2B P41595 4/20 0.34
BRD1 O95696 1/20 0.32
BRPF1 P55201 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL4784941 0.80 CA1 (0.40) CA12CA1CA2CA7CA14
SCHEMBL4786157 0.73 KDM4E (0.33) HTTSMN1; SMN2NPSR1
SCHEMBL2096744 0.68 METAP2 (0.33) MAPTALOX15ALDH1A1
SCHEMBL25080893 0.65 PTGER1 (0.49) KMT2A
SCHEMBL1948708 0.65 CA1 (0.47) CA12CA1CA2CA7MEN1
SCHEMBL2096746 0.65 METAP2 (0.51) CA12CA1CA2CA7CA14
SCHEMBL2982026 0.64 PNMT (0.48) CA12CA1CA2CA7CA14
SCHEMBL6524744 0.63 PDE5A (0.48) MEN1ALOX15TSHRKMT2ASMN1; SMN2
SCHEMBL8198838 0.63 CA12 (0.59) CA12CA1CA2CA7CA14
SCHEMBL1502098 0.62 ALOX5AP (0.40) CA1CA2CA7MEN1ALOX15

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-2008076046-A1 NOVEL 2-AMINO-5, 5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed