SCHEMBL21707952

SCHEMBL21707952

CC(CO)NS(=O)(=O)c1cc(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)n(C)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.51
▸ TP53 P04637 2/20 0.51
▸ LMNA P02545 3/20 0.46
▸ THRB P10828 2/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ HTR2B P41595 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ GRM4 Q14833 1/20 0.41
▸ AR P10275 1/20 0.39
▸ IDH2 P48735 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ HSD17B10 Q99714 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
SCHEMBL17700928 1.00 POLB (0.51) POLBTP53LMNATHRBTDP1
SCHEMBL16237422 0.90 TP53 (0.56) POLBTP53LMNATHRBTDP1
SCHEMBL17700845 0.89 HTR2B (0.53) POLBTP53LMNATHRBTDP1
SCHEMBL17700930 0.89 TP53 (0.52) POLBTP53LMNATHRBTDP1
SCHEMBL16237617 0.87 MEN1 (0.44) POLBTP53LMNATHRBTDP1
SCHEMBL17700935 0.87 MEN1 (0.44) POLBTP53LMNATHRBTDP1
SCHEMBL21707955 0.87 HTR2B (0.43) POLBTP53LMNATHRBTDP1
SCHEMBL16257366 0.87 HTR2B (0.43) POLBTP53LMNATHRBTDP1
SCHEMBL18407979 0.83 TP53 (0.49) POLBTP53LMNATHRBTDP1
SCHEMBL16257320 0.82 POLB (0.52) POLBTP53LMNATHRBTDP1

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
EP-3121164-B1 SULPHAMOYLPYRROLAMIDE DERIVATIVES AND THE USE THEREOF AS MEDICAMENTS FOR THE TREATMENT OF HEPATITIS B JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2020-02-19 — — EP disclosed
Send feedback