SCHEMBL7181807

SCHEMBL7181807

CCCN(C(C)=O)c1cc(N2CCCNCC2)ccc1S(=O)(=O)c1ccc(F)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 14/20 0.49
RORC P51449 1/20 0.38
CNR1 P21554 1/20 0.36
MAPKAPK2 P49137 1/20 0.36
LMNA P02545 1/20 0.36
GFER P55789 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DDR1 Q08345 2/20 0.35

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
SCHEMBL6741356 0.96 HTR6 (0.49) HTR6RORCCNR1MAPKAPK2LMNA
SCHEMBL6741207 0.93 HTR6 (0.50) HTR6RORCCNR1MAPKAPK2LMNA
SCHEMBL6744534 0.91 HTR6 (0.59) HTR6RORCCNR1
SCHEMBL6744293 0.90 HTR6 (0.50) HTR6RORCCNR1MAPKAPK2DDR1
SCHEMBL6741345 0.89 HTR6 (0.51) HTR6RORCCNR1MAPKAPK2LMNA
SCHEMBL6743687 0.89 HTR6 (0.61) HTR6
SCHEMBL6746878 0.88 HTR6 (0.52) HTR6RORCCNR1LMNAGFER
SCHEMBL6743164 0.88 RORC (0.41) HTR6RORCLMNAGFERSMN1; SMN2
SCHEMBL6741349 0.88 HTR6 (0.62) HTR6
SCHEMBL6744515 0.87 RORC (0.41) HTR6RORCLMNAGFERSMN1; SMN2

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
US-6579870-B2 5-(1,4-diazepan-1-yl)-2-((3 -fluorophenyl)sulfonyl)phenylamine for example; treatment of diseases or disorders of the central nervous system; modulation of serotonin (5-HT) activity PHARMACIA & UPJOHN COMPANY 2003-06-17 US claimed
US-20020037892-A1 Bis-arylsulfones PHARMACIA & UPJOHN COMPANY 2002-03-28 US claimed
US-6579870-B2 5-(1,4-diazepan-1-yl)-2-((3 -fluorophenyl)sulfonyl)phenylamine for example; treatment of diseases or disorders of the central nervous system; modulation of serotonin (5-HT) activity PHARMACIA & UPJOHN COMPANY 2003-06-17 US disclosed
US-20020037892-A1 Bis-arylsulfones PHARMACIA & UPJOHN COMPANY 2002-03-28 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-20020037892-A1 Bis-arylsulfones PMP22, ARSA, CLN6 HTR6 35/4885RORC 387/4885CNR1 118/4885

“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.