SCHEMBL4784941

SCHEMBL4784941

O=S(=O)(Oc1ccc(-c2c[nH]cn2)cc1)c1ccc2c(c1)CCC2

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
APEX1 P27695 1/20 0.39
STS P08842 1/20 0.38
ALDH1A1 P00352 1/20 0.36
TSHR P16473 2/20 0.36
ALOX15 P16050 2/20 0.35
KIT P10721 1/20 0.35
HSD17B10 Q99714 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
BRD4 O60885 1/20 0.32
HPGD P15428 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MLNR O43193 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
SCHEMBL4784933 0.80 CA12 (0.38) CA1CA2CA12CA7CA14
SCHEMBL4786164 0.71 CA2 (0.39) CA1CA2CA12ALDH1A1LMNA
SCHEMBL9958040 0.65 STS (0.57) CA2CA12STSALDH1A1SMN1; SMN2
SCHEMBL8198838 0.65 CA12 (0.59) CA1CA2CA12CA7CA14
SCHEMBL25081087 0.64 ADAMTS4 (0.43) SMN1; SMN2LMNA
SCHEMBL25080792 0.64 CA12 (0.57) CA1CA2CA12CA7ALDH1A1
SCHEMBL25080867 0.64 CYP4F2 (0.50) CA1CA2CA12CA7
SCHEMBL20054187 0.63 AKT1 (0.30)
SCHEMBL2202915 0.63 NPC1 (0.47) CA1CA2CA12CA7CA14
SCHEMBL4378238 0.63 SMN1; SMN2 (0.50) ALDH1A1TSHRALOX15SMN1; SMN2LMNA

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