SCHEMBL15416658

SCHEMBL15416658

Cc1cc2cc(Cl)ccc2n1CCCS(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CCR2 P41597 2/20 0.39
MAPT P10636 1/20 0.39
HTR6 P50406 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
SCHEMBL16235811 0.88 KDM4E (0.48) ACLYKDM4EMEN1ALDH1A1GAA
SCHEMBL15416657 0.85 NUDT1 (0.36) CCR2
SCHEMBL15416636 0.83 NUDT1 (0.40)
SCHEMBL16235734 0.82 MEN1 (0.43) ACLYKDM4EMEN1ALDH1A1GAA
SCHEMBL23301686 0.82 CCR2 (0.55) ACLYCCR2
SCHEMBL23330647 0.82 ACLY (0.41) ACLYCCR2
SCHEMBL31119628 0.81 KDM4E (0.68) ACLYKDM4EMEN1ALDH1A1GAA
SCHEMBL16235686 0.80 ACLY (0.38) ACLY
SCHEMBL15416457 0.80
SCHEMBL15416321 0.80 NOD2 (0.47) KDM4EMEN1ALDH1A1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2872502-A1 NOVEL INDAZOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION F. Hoffmann-La Roche AG (CH) 2015-05-20 EP disclosed
WO-2014009302-A1 NOVEL INDAZOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2014-01-16 WO disclosed