SCHEMBL10697215

SCHEMBL10697215

CC(=O)c1ccc2c(c1)C(n1nc(O)ccc1=O)=CC(C)(C)O2

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.34
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
RARG P13631 1/20 0.33
KDM4E B2RXH2 2/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
PDK2 Q15119 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
SCHEMBL10697118 0.88 RAB9A (0.37) RARARARBRARGPDK2
SCHEMBL10696972 0.87 RARA (0.31) RARARARBRARG
SCHEMBL10693640 0.86 MAPT (0.41) RARARARB
SCHEMBL10696788 0.82
SCHEMBL10694946 0.81 PDE4A (0.41) KDM4E
SCHEMBL10694147 0.81 ALDH1A1 (0.36) S100A4NR1H2NR1H3
SCHEMBL8084539 0.80 S100A4 (0.32) S100A4KDM4E
SCHEMBL7377496 0.78 CCNC (0.30)
SCHEMBL7277136 0.77 S100A4 (0.38) S100A4RARARARBRARGKDM4E
SCHEMBL10697122 0.76 MAPT (0.34) S100A4RARARARBRARGKDM4E

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-0273262-A2 Chroman derivatives MERCK PATENT GmbH (DE) 1988-07-06 EP disclosed