SCHEMBL13639317

SCHEMBL13639317

COc1cc(OC(=O)c2cccnc2OC)ccc1-c1ccc2c(c1COc1cc(F)ccc1C)NC(=O)C(C)(C)N2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IL6 P05231 8/20 0.51
DRD1 P21728 1/20 0.34
SYK P43405 1/20 0.33
MAPT P10636 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
PLIN1 O60240 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TNNI3 P19429 1/20 0.32
TNNT2 P45379 1/20 0.32
TNNC1 P63316 1/20 0.32
PLIN5 Q00G26 1/20 0.32
KMT2A Q03164 1/20 0.32
ABHD5 Q8WTS1 1/20 0.32
LMNA P02545 2/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SGMS2 Q8NHU3 1/20 0.32

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
SCHEMBL13639334 0.92 IL6 (0.54) IL6MAPTTDP1KDM4EMEN1
SCHEMBL4135610 0.88 IL6 (0.68) IL6DRD1SYKMAPTTDP1
SCHEMBL1313495 0.86 IL6 (0.46) IL6MAPTTDP1LMNATP53
SCHEMBL13639301 0.86 IL6 (0.60) IL6SYKMAPTHTT
SCHEMBL13639310 0.85 IL6 (0.51) IL6MAPTTDP1KDM4EMEN1
SCHEMBL13639328 0.85 IL6 (0.55) IL6
SCHEMBL13639320 0.82 IL6 (0.63) IL6
SCHEMBL4135439 0.81 IL6 (0.69) IL6SYKMAPTTDP1KDM4E
SCHEMBL13639356 0.80 IL6 (0.50) IL6TP53
SCHEMBL1313204 0.79 IL6 (0.46) IL6MAPTTDP1LMNATP53

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-1995242-B1 NOVEL 1,2,3,4-TETRAHYDROQUINOXALINE DERIVATIVE HAVING GLUCOCORTICOID RECEPTOR BINDING ACTIVITY SANTEN PHARMACEUTICAL CO LTD (JP) 2012-11-07 EP disclosed