SCHEMBL27528131

SCHEMBL27528131

S=CC1=NSc2ccccc2C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL27272787 0.81 ALDH1A1 (0.37) KDM4EALDH1A1HPGD
SCHEMBL1868060 0.75 ALDH1A1 (0.36) KDM4EALDH1A1HPGD
SCHEMBL3081411 0.74 ALDH1A1 (0.38) KDM4EALDH1A1HPGD
SCHEMBL3129155 0.71 MEN1 (0.37) KDM4EALDH1A1HPGD
SCHEMBL4103011 0.71 ALDH1A1 (0.37) KDM4EALDH1A1HPGD
SCHEMBL11708484 0.71 HPGD (0.37) KDM4EALDH1A1HPGD
SCHEMBL8735560 0.71 ALDH1A1 (0.36) KDM4EALDH1A1HPGD
SCHEMBL9211141 0.66 ALDH1A1 (0.47) KDM4EALDH1A1HPGD
SCHEMBL8288 0.66 MAOA (0.38) KDM4EALDH1A1HPGD
SCHEMBL3619022 0.64 ALDH1A1 (0.36) KDM4EALDH1A1HPGD

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-1636005-A Benzothiazinone and benzoxazinone compounds KNOLL AG (DE) 2005-07-06 CN disclosed
CN-1062140-A The replacement benzoxazine-and benzothiazine compound and preparation method KALI CHEMIE PHARMA GMBH (DE) 1992-06-24 CN disclosed