SCHEMBL9719880

SCHEMBL9719880

Nc1ccc(OCc2ccccn2)c(Cl)c1Cl

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 13/20 0.58
SLC6A4 P31645 1/20 0.46
AURKB Q96GD4 4/20 0.46
INCENP Q9NQS7 4/20 0.46
ABCB1 P08183 1/20 0.46
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
ALDH1A1 P00352 2/20 0.43
USP2 O75604 1/20 0.43
PARP10 Q53GL7 1/20 0.42
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
KDM4E B2RXH2 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL30729929 0.87 SYK (0.55) SYKSLC6A4AURKBINCENPABCB1
SCHEMBL27096930 0.87 SYK (0.55) SYKSLC6A4AURKBINCENPABCB1
SCHEMBL9719784 0.78 SYK (0.58) SYKAURKBINCENPABCB1HTR1A
SCHEMBL8308720 0.78 SYK (0.51) SYKAURKBINCENPABCB1HTR1A
SCHEMBL9719890 0.78 SYK (0.48) SYKSLC6A4AURKBINCENPABCB1
SCHEMBL9719796 0.78 SYK (0.48) SYKSLC6A4AURKBINCENPABCB1
SCHEMBL27299165 0.78 SYK (0.49) SYKSLC6A4AURKBINCENPABCB1
SCHEMBL159323 0.77 SYK (0.78) SYKSLC6A4AURKBINCENPABCB1
SCHEMBL29638125 0.77 SYK (0.78) SYKSLC6A4AURKBINCENPABCB1
Ammonia Solution, Strong SCHEMBL23859934 0.76 SYK (0.76) SYKSLC6A4AURKBINCENPABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5157039-A Lipoxygenase inhibitors LEO PHARMACEUTICAL PRODUCTS LTD. (DK) 1992-10-20 US disclosed
US-5109009-A QUINOLINE AND PYRIDINE COMPOUNDS AND INHIBITION OF 5-LIPOXYGENASES THEREWITH LEO PHARMACEUTICAL PRODUCTS LTD. (DK) 1992-04-28 US disclosed
US-4826987-A Pyridyl and quinoline derivatives LEO PHARMACEUTICAL PRODUCTS LTD. (DK) 1989-05-02 US disclosed