SCHEMBL21707955

SCHEMBL21707955

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 1/20 0.43
▸ THRB P10828 3/20 0.43
▸ TP53 P04637 3/20 0.41
▸ POLB P06746 3/20 0.41
▸ LMNA P02545 3/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 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
SCHEMBL16257366 1.00 HTR2B (0.43) HTR2BTHRBTP53POLBLMNA
SCHEMBL17700845 0.91 HTR2B (0.53) HTR2BTHRBTP53POLBLMNA
SCHEMBL17700935 0.89 MEN1 (0.44) HTR2BTHRBTP53POLBLMNA
SCHEMBL16237617 0.89 MEN1 (0.44) HTR2BTHRBTP53POLBLMNA
SCHEMBL17700928 0.87 POLB (0.51) HTR2BTHRBTP53POLBLMNA
SCHEMBL21707952 0.87 POLB (0.51) HTR2BTHRBTP53POLBLMNA
SCHEMBL21727545 0.83 HTR2B (0.53) HTR2BTHRBTP53POLBLMNA
SCHEMBL17700926 0.83 HTR2B (0.53) HTR2BTHRBTP53POLBLMNA
SCHEMBL18407892 0.83 THRB (0.41) THRBTP53POLBLMNATDP1
SCHEMBL16236804 0.82 TP53 (0.46) THRBTP53POLBLMNATDP1

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
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