SCHEMBL27636697

SCHEMBL27636697

CCC1c2ccccc2-c2cc(-c3ccsc3)ccc2N1C=CCS(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.35
IDH2 P48735 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
SCHEMBL27617631 0.90 DHODH (0.30) PTPRC
SCHEMBL27636772 0.85 ESR1 (0.34)
SCHEMBL27617674 0.84 CYP1A2 (0.32)
SCHEMBL5213502 0.82 PSEN1 (0.41) PTPRCIDH2
SCHEMBL27636716 0.78 CTSK (0.34)
SCHEMBL27617676 0.76 ALDH1A1 (0.32)
SCHEMBL28757626 0.76 CYP11B1 (0.41)
SCHEMBL27636782 0.76 ALDH1A1 (0.36)
SCHEMBL28757641 0.75 ESR1 (0.35)
SCHEMBL28754639 0.75 ESR1 (0.39)

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
CN-1720231-A Substituted dihydrophenanthridinesulfonamides WYETH CORP (US) 2006-01-11 CN claimed
CN-1720231-A Substituted dihydrophenanthridinesulfonamides WYETH CORP (US) 2006-01-11 CN disclosed