SCHEMBL2799982

SCHEMBL2799982

Cc1cc(C(N)=O)ncc1C(SCCC(C)(F)F)c1c(F)ccc(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
CYP3A4 P08684 1/20 0.33
KMT2A Q03164 1/20 0.31
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
SCHEMBL2795244 0.91 KMT2A (0.30) NR3C1PGRCYP3A4KMT2A
SCHEMBL2797367 0.86
SCHEMBL2795813 0.85
SCHEMBL2793819 0.84
SCHEMBL2793624 0.84 KMT2A (0.31) NR3C1PGRCYP3A4KMT2AVNN1
SCHEMBL13262613 0.84 KMT2A (0.37) KMT2AVNN1
SCHEMBL2798685 0.83
SCHEMBL2794558 0.82 PDE2A (0.33)
SCHEMBL2796707 0.82 DRD2 (0.30)
SCHEMBL2796960 0.81 GABRA1 (0.34) CYP3A4

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 NR3C1 1716/4885PGR 4308/4885CYP3A4 1786/4885

“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.