SCHEMBL17801538

SCHEMBL17801538

CC1(C)C=C(c2ccc(S(=O)(=O)Nc3cc4c[nH]c(=O)cc4cc3F)s2)N=NC1=O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATIC P31939 12/20 0.47
GHSR Q92847 3/20 0.33
THRB P10828 1/20 0.32
CASP6 P55212 1/20 0.32
PRNP P04156 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
ACLY P53396 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL17801496 0.77 ATIC (0.51) ATICGHSRTHRBACLYTP53
SCHEMBL17801523 0.75 THRB (0.57) ATICTHRBTP53POLBMAPT
SCHEMBL17801458 0.74 ATIC (0.46) ATICGHSRTHRBACLY
SCHEMBL17801533 0.74 ATIC (0.73) ATICGHSRTHRB
SCHEMBL17801597 0.73 ATIC (0.50) ATICGHSRTHRBACLY
SCHEMBL17801648 0.68
SCHEMBL17801608 0.67 ATIC (0.46) ATICTHRB
SCHEMBL17801500 0.65 ATIC (0.54) ATICGHSR
SCHEMBL17801631 0.61 ATIC (0.72) ATICGHSRTHRB
SCHEMBL19205908 0.60 ATIC (1.00) ATICGHSRTHRB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3227279-A1 1 -OXO-1,2-DIHYDROISOQUINOLIN-7-YL-(5-SUBSTITUTED-THIOPHEN-2-YL)-SULFONAMIDE COMPOUNDS, FORMULATIONS CONTAINING THOSE COMPOUNDS, AND THEIR USE AS AICARFT INHIBITORS IN THE TREATMENT OF CANCERS Eli Lilly and Company (US) 2017-10-11 EP claimed
WO-2016089670-A1 1 -OXO-1,2-DIHYDROISOQUINOLIN-7-YL-(5-SUBSTITUTED-THIOPHEN-2-YL)-SULFONAMIDE COMPOUNDS, FORMULATIONS CONTAINING THOSE COMPOUNDS, AND THEIR USE AS AICARFT INHIBITORS IN THE TREATMENT OF CANCERS ELI LILLY AND COMPANY (US) 2016-06-09 WO claimed
EP-3836929-A1 METHODS OF TREATING LIVER DISEASES Camp4 Therapeutics Corporation (US) 2021-06-23 EP disclosed
WO-2020037069-A1 METHODS OF TREATING LIVER DISEASES CAMP4 THERAPEUTICS CORPORATION (US) 2020-02-20 WO disclosed
EP-3227279-A1 1 -OXO-1,2-DIHYDROISOQUINOLIN-7-YL-(5-SUBSTITUTED-THIOPHEN-2-YL)-SULFONAMIDE COMPOUNDS, FORMULATIONS CONTAINING THOSE COMPOUNDS, AND THEIR USE AS AICARFT INHIBITORS IN THE TREATMENT OF CANCERS Eli Lilly and Company (US) 2017-10-11 EP disclosed
WO-2016089670-A1 1 -OXO-1,2-DIHYDROISOQUINOLIN-7-YL-(5-SUBSTITUTED-THIOPHEN-2-YL)-SULFONAMIDE COMPOUNDS, FORMULATIONS CONTAINING THOSE COMPOUNDS, AND THEIR USE AS AICARFT INHIBITORS IN THE TREATMENT OF CANCERS ELI LILLY AND COMPANY (US) 2016-06-09 WO disclosed