SCHEMBL9110599

SCHEMBL9110599

[CH2]C=CCC1CNCCN1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.31
PARP1 P09874 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
SCHEMBL9110587 0.86
SCHEMBL9113903 0.80 CXCR4 (0.34)
SCHEMBL11667201 0.79 LTA4H (0.31) LTA4HPARP1
SCHEMBL26756536 0.79 LTA4H (0.31) LTA4HPARP1
SCHEMBL9109822 0.79
SCHEMBL791126 0.78
SCHEMBL9111095 0.77 CXCR4 (0.39)
SCHEMBL17688543 0.74
SCHEMBL27266751 0.74
SCHEMBL11128996 0.72 KDM4E (0.31) PARP1

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-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed