SCHEMBL7822980

SCHEMBL7822980

[CH2]SC1=CCc2ccccc2S1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL9216566 0.74 ALDH1A1 (0.37) KDM4EALDH1A1HPGD
SCHEMBL3077212 0.73 ALDH1A1 (0.44) KDM4EALDH1A1HPGD
SCHEMBL3833166 0.69 ALDH1A1 (0.38) KDM4EALDH1A1HPGD
SCHEMBL14137780 0.69 MEN1 (0.38) KDM4EALDH1A1HPGD
SCHEMBL3074711 0.69 MEN1 (0.38) KDM4EALDH1A1HPGD
SCHEMBL3074985 0.69 ALDH1A1 (0.37) KDM4EALDH1A1HPGD
SCHEMBL9008647 0.67 ALDH1A1 (0.39) KDM4EALDH1A1HPGD
SCHEMBL6419546 0.65 ALDH1A1 (0.38) KDM4EALDH1A1HPGD
SCHEMBL6412918 0.65 KDM4E (0.34) KDM4EALDH1A1HPGD
SCHEMBL3965427 0.65 ALDH1A1 (0.34) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1090920-A1 CEPHEM COMPOUNDS ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2001-04-11 EP disclosed