SCHEMBL4287004

SCHEMBL4287004

O=C(N[C@H]1CCCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)C1)C1CCCCC1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 0.79
TSHR P16473 1/20 0.68
KMT2A Q03164 4/20 0.64
MEN1 O00255 2/20 0.58
LMNA P02545 2/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
ALDH1A1 P00352 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
RAB9A P51151 1/20 0.53
LIPE Q05469 1/20 0.53

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
SCHEMBL4006097 0.86 TSHR (0.90) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4006092 0.86 TSHR (0.90) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4004680 0.85 KMT2A (0.87) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4004673 0.85 KMT2A (0.87) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4004803 0.85 KMT2A (0.87) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4005572 0.83 TSHR (0.67) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4005584 0.83 TSHR (0.67) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4006602 0.83 KMT2A (0.68) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4155964 0.83 EPHX2 (0.77) EPHX2TSHRKMT2AMEN1LMNA
SCHEMBL4006595 0.83 KMT2A (0.68) EPHX2TSHRKMT2AMEN1LMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060122197-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-06-08 US claimed
EP-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP disclosed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP disclosed
US-20060122197-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-06-08 US disclosed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO 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-20060122197-A1 Amido compounds and their use as pharmaceuticals HSD11B1, CYP11B1, HSD11B2 EPHX2 788/4885TSHR 328/4885KMT2A 3418/4885

“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.