SCHEMBL20033697

SCHEMBL20033697

CCCNS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(F)c(Cl)c2)c1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 11/20 0.66
MAPT P10636 10/20 0.66
RECQL P46063 1/20 0.66
TP53 P04637 10/20 0.62
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
NPSR1 Q6W5P4 1/20 0.59
POLB P06746 1/20 0.55
KDM4E B2RXH2 2/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
HTT P42858 1/20 0.53
XBP1 P17861 1/20 0.52
ALDH1A1 P00352 1/20 0.52

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
SCHEMBL15613050 0.90 MAPT (0.61) LMNAMAPTRECQLTP53MEN1
SCHEMBL15847362 0.83 MAPT (0.56) LMNAMAPTRECQLTP53KMT2A
SCHEMBL15847785 0.83 MAPT (0.61) LMNAMAPTRECQLTP53MEN1
SCHEMBL17668340 0.83 LMNA (0.59) LMNAMAPTRECQLTP53MEN1
SCHEMBL15847595 0.83 KMT2A (0.63) LMNAMAPTRECQLTP53KMT2A
SCHEMBL15847593 0.83 KMT2A (0.63) LMNAMAPTRECQLTP53KMT2A
SCHEMBL15848010 0.83 KMT2A (0.63) LMNAMAPTRECQLTP53KMT2A
SCHEMBL14484956 0.83 MAPT (0.70) LMNAMAPTRECQLTP53MEN1
SCHEMBL14488016 0.82 LMNA (0.58) LMNAMAPTRECQLTP53MEN1
SCHEMBL17465703 0.82 KMT2A (0.59) LMNAMAPTRECQLTP53KMT2A

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-9938236-B2 Antiviral agents against HBV infection DREXEL UNIVERSITY (US) 2018-04-10 US disclosed