SCHEMBL18407979

SCHEMBL18407979

C[C@H](CO)N(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)n(C)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.49
▸ POLB P06746 3/20 0.49
▸ LMNA P02545 4/20 0.44
▸ THRB P10828 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ MAPT P10636 3/20 0.40
▸ GRM4 Q14833 1/20 0.39
▸ UBE2M P61081 1/20 0.38
▸ DCUN1D1 Q96GG9 1/20 0.38
▸ AR P10275 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.37
▸ CCR2 P41597 1/20 0.37
▸ CCR5 P51681 1/20 0.37

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
SCHEMBL18407892 0.87 THRB (0.41) TP53POLBLMNATHRBTDP1
SCHEMBL21727535 0.86 POLB (0.45) TP53POLBLMNATHRBTDP1
SCHEMBL21707952 0.83 POLB (0.51) TP53POLBLMNATHRBTDP1
SCHEMBL17700928 0.83 POLB (0.51) TP53POLBLMNATHRBTDP1
SCHEMBL16237422 0.81 TP53 (0.56) TP53POLBLMNATHRBTDP1
SCHEMBL18407909 0.80 TP53 (0.57) TP53POLBLMNATHRBTDP1
SCHEMBL17700930 0.79 TP53 (0.52) TP53POLBLMNATHRBTDP1
SCHEMBL18407881 0.79 POLB (0.44) TP53POLBLMNATHRBTDP1
SCHEMBL16257320 0.77 POLB (0.52) TP53POLBLMNATHRBTDP1
SCHEMBL16257235 0.74 POLB (0.51) TP53POLBLMNATHRBTDP1

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-A1 SULPHAMOYLPYRROLAMIDE DERIVATIVES AND THE USE THEREOF AS MEDICAMENTS FOR THE TREATMENT OF HEPATITIS B Janssen Sciences Ireland UC (IE) 2017-01-25 — — EP disclosed
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