SCHEMBL27995397

SCHEMBL27995397

Cc1ccc(S(=O)(=O)N2CCC(=O)c3cc(Cl)ccc32)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.50
TP53 P04637 5/20 0.50
HTR6 P50406 2/20 0.50
LMNA P02545 1/20 0.50
KCNN4 O15554 2/20 0.48
KCNA3 P22001 2/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MMP2 P08253 1/20 0.46
POLB P06746 2/20 0.45

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
SCHEMBL31585998 0.93 MAPT (0.56) MAPTTP53LMNAKCNN4KCNA3
SCHEMBL533706 0.93 MAPT (0.56) MAPTTP53LMNAKCNN4KCNA3
SCHEMBL2704794 0.92 KMT2A (0.56) MAPTTP53HTR6KCNN4KCNA3
SCHEMBL4726759 0.90 HTR6 (0.50) MAPTTP53HTR6LMNAKCNN4
SCHEMBL26159157 0.82 MAPT (0.51) MAPTTP53HTR6LMNAKCNN4
SCHEMBL8466244 0.82 KMT2A (0.53) MAPTTP53HTR6LMNAKCNN4
SCHEMBL2705025 0.82 PSEN1 (0.56) MAPTTP53HTR6KCNN4KCNA3
SCHEMBL768700 0.81 KCNN4 (0.67) MAPTTP53HTR6LMNAKCNN4
SCHEMBL9538299 0.81 ALDH1A1 (0.49) MAPTHTR6LMNAKMT2APOLB
SCHEMBL31585919 0.80 MAPT (0.44) MAPTTP53LMNAKCNN4KCNA3

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
CN-104672213-A Amide compound with antitumor activity, and application thereof UNIV SHAANXI TECHNOLOGY 2015-06-03 CN disclosed