SCHEMBL7314490

SCHEMBL7314490

O=S(=O)(Cl)Cc1noc2cc(F)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
LMNA P02545 1/20 0.45
CA3 P07451 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
MAOB P27338 1/20 0.45
CA5A P35218 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA13 Q8N1Q1 1/20 0.45
CA14 Q9ULX7 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
DRD2 P14416 12/20 0.43
HTR2A P28223 12/20 0.43
HTR7 P34969 12/20 0.43
HTR6 P50406 12/20 0.43
CYP3A4 P08684 1/20 0.41
BLM P54132 1/20 0.41

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
SCHEMBL7315256 0.88 LMNA (0.45) CA12CA1CA2LMNACA3
SCHEMBL7316085 0.85 CA12 (0.65) CA12CA1CA2LMNACA3
SCHEMBL3143718 0.78 LMNA (0.73) CA12CA1CA2LMNACA3
SCHEMBL24410388 0.76 DRD2 (0.47) DRD2HTR2AHTR7HTR6ACHE
SCHEMBL2774476 0.76 ACHE (0.42) DRD2HTR2AHTR7HTR6ACHE
SCHEMBL19141702 0.76 ACHE (0.42) CA12CA1CA2LMNACA3
SCHEMBL19119196 0.75 CA2 (0.45) CA12CA1CA2LMNACA3
SCHEMBL7319885 0.74 LMNA (0.46) CA12CA1CA2LMNACA3
SCHEMBL7307801 0.74 LMNA (0.62) CA12CA1CA2LMNACA3
SCHEMBL8116328 0.74 MAPT (0.56) LMNADRD2HTR2AHTR7HTR6

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
US-4172896-A ANTICONVULSANTS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1979-10-30 US disclosed