SCHEMBL4927115

SCHEMBL4927115

CCN(CC)S(=O)(=O)c1ccc(C(N)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 6/20 0.56
LMNA P02545 6/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
ABCC9 O60706 1/20 0.50
ABCC8 Q09428 1/20 0.50
KCNJ11 Q14654 1/20 0.50
KCNJ8 Q15842 1/20 0.50
KDM1A O60341 1/20 0.48
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NPSR1 Q6W5P4 2/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 2/20 0.45
GAA P10253 2/20 0.45

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
SCHEMBL28035458 0.83 HTT (0.63) HTTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL4926815 0.82 SMN1; SMN2 (0.56) HTTLMNASMN1; SMN2ALDH1A1MEN1
SCHEMBL14349177 0.78 HTT (0.66) HTTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL3314209 0.73 LMNA (0.70) HTTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL3246445 0.73 ALDH1A1 (0.73) HTTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL27312349 0.73 HTT (0.56) HTTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL23057256 0.71 LMNA (0.73) HTTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL5023540 0.71 HTT (0.73) HTTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL10592845 0.71 LMNA (0.73) HTTLMNASMN1; SMN2NPC1RAB9A
SCHEMBL5018967 0.70 LMNA (0.66) HTTLMNASMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008098103-A1 METHOD FOR PREPARING HALOGENATED AMINES WYETH (US) 2008-08-14 WO disclosed
US-20080188659-A1 Method for Preparing Halogenated Amines WYETH (US) 2008-08-07 US disclosed
US-20080188659-A1 Method for Preparing Halogenated Amines WYETH (US) 2008-08-07 US disclosed
US-20080188659-A1 Method for Preparing Halogenated Amines WYETH (US) 2008-08-07 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-20080188659-A1 Method for Preparing Halogenated Amines PNMT, ABL1, INMT HTT 561/4885LMNA 1481/4885SMN1; SMN2 3833/4885

“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.