SCHEMBL8407231

SCHEMBL8407231

CC1C[N]CCN1c1cccc(S(N)(=O)=O)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 11/20 0.45
CA2 P00918 11/20 0.45
CA9 Q16790 7/20 0.45
LMNA P02545 1/20 0.43
CA12 O43570 5/20 0.42
CA7 P43166 3/20 0.42
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
BMPR2 Q13873 2/20 0.39
CA4 P22748 2/20 0.37
CA14 Q9ULX7 1/20 0.37
MTOR P42345 1/20 0.37

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
SCHEMBL6867684 0.79 ALOX5 (0.43) LMNA
SCHEMBL1365728 0.77 GFER (0.48) LMNA
SCHEMBL6869847 0.75 MAPT (0.44) LMNA
SCHEMBL6865906 0.75 MAPK1 (0.44)
SCHEMBL38652751 0.67 CA1 (0.55) CA1CA2CA9LMNACA12
SCHEMBL7952397 0.67 CA1 (0.55) CA1CA2CA9LMNACA12
SCHEMBL17856468 0.66 CA1 (0.53) CA1CA2CA9LMNACA12
SCHEMBL6869329 0.66 LMNA (0.37) LMNA
SCHEMBL16966426 0.66 CA1 (0.48) CA1CA2CA9LMNACA12
SCHEMBL9198386 0.64 CA1 (0.55) CA1CA2CA9LMNACA12

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-5919784-A ANXIETY, DEPRESSION ADIR ET COMPAGNIE (FR) 1999-07-06 US disclosed