SCHEMBL4005331

SCHEMBL4005331

Cc1ccc(S(=O)(=O)N2CCNC2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.59
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
PKM P14618 3/20 0.51
MAPT P10636 2/20 0.51
RECQL P46063 1/20 0.51
ALDH1A1 P00352 2/20 0.50
POLB P06746 2/20 0.50
HTT P42858 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 2/20 0.46
TSHR P16473 1/20 0.46
CYP2C19 P33261 1/20 0.46
KCNN4 O15554 1/20 0.46
KCNA3 P22001 1/20 0.46

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
SCHEMBL11584726 0.83 MMP2 (0.59) MMP2PKMMAPTALDH1A1POLB
SCHEMBL6529191 0.82 CYP2C9 (0.56) MMP2PKMMAPTALDH1A1POLB
SCHEMBL9491524 0.79 KCNN4 (0.49) MMP2PKMMAPTALDH1A1POLB
SCHEMBL29482655 0.79 KCNN4 (0.49) MMP2PKMMAPTALDH1A1POLB
SCHEMBL3928664 0.77 GFER (0.69) MMP2PKMMAPTRECQLALDH1A1
SCHEMBL7995378 0.76 MMP2 (0.44) MMP2CA1CA2PKMMAPT
SCHEMBL7995381 0.76 MMP2 (0.44) MMP2CA1CA2PKMMAPT
SCHEMBL27638859 0.76 MAPT (0.48) MMP2CA1CA2PKMMAPT
SCHEMBL20552743 0.75 ALDH1A1 (0.40) MMP2PKMMAPTALDH1A1POLB
SCHEMBL11357852 0.75 MAPT (0.58) MMP2CA1CA2PKMMAPT

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-2009078992-A1 LINEAR TRICYCLIC COMPOUNDS AS P38 KINASE INHIBITORS AMGEN INC. (US) 2009-06-25 WO disclosed