SCHEMBL2798565

SCHEMBL2798565

NC(=O)c1cc(C(SCCC(F)(F)F)c2c(F)ccc(F)c2F)c(Cl)cn1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 2/20 0.34
KMT2A Q03164 1/20 0.31
MET P08581 2/20 0.30
KDR P35968 2/20 0.30
AURKA O14965 1/20 0.30
ABL1 P00519 1/20 0.30
LCK P06239 1/20 0.30
FYN P06241 1/20 0.30
YES1 P07947 1/20 0.30
FGFR2 P21802 1/20 0.30
EPHA2 P29317 1/20 0.30
LTK P29376 1/20 0.30
AXL P30530 1/20 0.30
FLT3 P36888 1/20 0.30
MST1R Q04912 1/20 0.30
PTK6 Q13882 1/20 0.30
VNN1 O95497 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
SCHEMBL2797787 0.82
SCHEMBL2795244 0.81 KMT2A (0.30) KMT2A
SCHEMBL2795900 0.81 TGFBR1 (0.34) TGFBR1KMT2A
SCHEMBL13262439 0.81 LOXL2 (0.32)
SCHEMBL2799982 0.80 NR3C1 (0.33) KMT2AVNN1
SCHEMBL2796960 0.77 GABRA1 (0.34) LCK
SCHEMBL13262444 0.76 KMT2A (0.37) KMT2AVNN1
SCHEMBL2793819 0.74
SCHEMBL2793624 0.74 KMT2A (0.31) KMT2AVNN1
SCHEMBL2797367 0.73

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
EP-2204365-A1 ALKYLSULFONE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2010-07-07 EP disclosed
US-20100168136-A1 ALKYLSULFONE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-07-01 US disclosed
US-20100168136-A1 ALKYLSULFONE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-07-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100168136-A1 ALKYLSULFONE DERIVATIVES BACE1, APP, AMY1A TGFBR1 1806/4885KMT2A 4719/4885MET 2591/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.