SCHEMBL27713643

SCHEMBL27713643

CC(C)(CC#Cc1ccccc1)C(CS(=O)(=O)N1CCN(c2ccc(F)cc2)CC1)NC(=O)NO

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
MMP13 P45452 3/20 0.42
MMP14 P50281 3/20 0.42
CYP3A4 P08684 2/20 0.42
LMNA P02545 4/20 0.40
POLB P06746 2/20 0.40
ADAMTS4 O75173 2/20 0.40
MAPT P10636 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KCNH2 Q12809 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2155065 0.92 TP53 (0.46) TP53MMP13MMP14CYP3A4LMNA
SCHEMBL2156215 0.90 MMP13 (0.46) TP53MMP13MMP14CYP3A4LMNA
SCHEMBL27693798 0.88 MMP13 (0.45) TP53MMP13MMP14CYP3A4LMNA
SCHEMBL28770879 0.88 MMP13 (0.45) TP53MMP13MMP14CYP3A4LMNA
SCHEMBL27693778 0.88 MMP13 (0.46) TP53MMP13MMP14CYP3A4POLB
SCHEMBL2155248 0.84 TP53 (0.42) TP53LMNAMAPT
SCHEMBL2155126 0.82 ATM (0.43) LMNAMAPT
SCHEMBL2155141 0.82 TP53 (0.41) TP53MMP13MMP14CYP3A4LMNA
SCHEMBL2154777 0.81 MMP13 (0.46) TP53MMP13MMP14CYP3A4LMNA
SCHEMBL2155021 0.80 MMP13 (0.48) TP53MMP13MMP14CYP3A4LMNA

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-101124213-A Sulfonylamino cyclic derivatives and uses thereof SERONO LAB (CH) 2008-02-13 CN disclosed