SCHEMBL7323459

SCHEMBL7323459

CCCc1c(C)c(N)c(C)c(S(=O)(=O)c2ccc(OC)cc2)c1C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
RAPGEF4 Q8WZA2 1/20 0.41
TP53 P04637 3/20 0.40
PKM P14618 2/20 0.40
CISD2 Q8N5K1 1/20 0.40
MMP13 P45452 4/20 0.39
MMP2 P08253 3/20 0.39
MMP8 P22894 3/20 0.39
MMP12 P39900 3/20 0.39
MMP14 P50281 3/20 0.39
MMP16 P51512 3/20 0.39
MMP9 P14780 3/20 0.39
MMP1 P03956 1/20 0.39
MMP3 P08254 1/20 0.39
ADAM17 P78536 1/20 0.39
MAPT P10636 3/20 0.39
GAA P10253 1/20 0.39
THRB P10828 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CNR1 P21554 1/20 0.39

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
SCHEMBL7317696 0.92 LMNA (0.42) LMNARAPGEF4TP53PKMCISD2
SCHEMBL7311552 0.91 RAPGEF4 (0.41) LMNARAPGEF4TP53PKMMMP13
SCHEMBL7312522 0.90 MMP13 (0.46) LMNARAPGEF4TP53MMP13MMP2
SCHEMBL7317781 0.86 RAPGEF4 (0.47) LMNARAPGEF4TP53PKMCISD2
SCHEMBL7317410 0.85 ALDH1A1 (0.47) LMNATP53PKMMMP13MMP2
SCHEMBL7315402 0.83 EGFR (0.45) LMNATP53MMP13MMP2MMP8
SCHEMBL7324368 0.82 CA1 (0.42) LMNARAPGEF4TP53PKMCISD2
SCHEMBL7314232 0.82 MMP2 (0.48) LMNATP53MMP13MMP2MMP8
SCHEMBL7317729 0.81 RAPGEF4 (0.43) LMNARAPGEF4TP53PKMMMP13
SCHEMBL7324085 0.81 HTT (0.43) LMNARAPGEF4TP53CISD2MMP13

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-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed