SCHEMBL8322816

SCHEMBL8322816

Cc1ccccc1N1CCc2c(Cl)nc3cccc(OCC(F)(F)F)c3c21

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 1/20 0.38
DCPS Q96C86 1/20 0.37

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
SCHEMBL7488451 0.84 KDM4E (0.52) KDM4EALDH1A1
SCHEMBL7492292 0.77 KDM4E (0.50) KDM4EALDH1A1
SCHEMBL7496616 0.74 KDM4E (0.62) KDM4EALDH1A1
SCHEMBL7489877 0.74 KDM4E (0.45) KDM4EALDH1A1
SCHEMBL7484334 0.74 KDM4E (0.49) KDM4EALDH1A1
SCHEMBL7484498 0.73 KDM4E (0.54) KDM4EALDH1A1
SCHEMBL7487898 0.72 KDM4E (0.50) KDM4EALDH1A1
SCHEMBL7488966 0.72 ADRA1D (0.42) KDM4EALDH1A1
SCHEMBL7493695 0.71 KDM4E (0.42) KDM4EALDH1A1
SCHEMBL7487726 0.71 KDM4E (0.46) KDM4EALDH1A1

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-0966466-A1 PYRROLO 3,2-c]QUINOLINE DERIVATIVES CONTAINING HALOALKOXY GROUP AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1999-12-29 EP disclosed
WO-1999009029-A1 PYRROLO[3,2-c]QUINOLINE DERIVATIVES CONTAINING HALOALKOXY GROUP AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1999-02-25 WO disclosed