SCHEMBL7182771

SCHEMBL7182771

CC(=O)Nc1cc(N2CCN(C)CC2)ccc1S(=O)(=O)c1cc(F)cc(F)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.59
POLB P06746 2/20 0.44
CYP3A4 P08684 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
IGF1R P08069 2/20 0.42
RAD52 P43351 1/20 0.42
KMT2A Q03164 2/20 0.42
MAPK1 P28482 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL7177437 0.96 HTR6 (0.55) HTR6POLBCYP3A4HDAC3HDAC8
SCHEMBL6747277 0.91 HTR6 (0.62) HTR6POLBCYP3A4HDAC3HDAC8
SCHEMBL6745742 0.90 HTR6 (0.61) HTR6POLBCYP3A4HDAC3HDAC8
SCHEMBL6744357 0.88 HTR6 (0.77) HTR6POLBCYP3A4KMT2AMAPK1
SCHEMBL6742345 0.87 HTR6 (0.58) HTR6POLBCYP3A4HDAC3HDAC8
SCHEMBL6745790 0.87 HTR6 (0.57) HTR6POLBCYP3A4HDAC3HDAC8
SCHEMBL6743416 0.87 HTR6 (0.58) HTR6POLBCYP3A4HDAC3HDAC8
SCHEMBL27497165 0.86 ALDH1A1 (0.46) HTR6POLBIGF1RKMT2ANPC1
SCHEMBL6743538 0.86 HTR6 (0.78) HTR6POLBCYP3A4KMT2AMAPK1
SCHEMBL6743470 0.86 HTR6 (0.58) HTR6POLBRAD52KMT2AMAPK1

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
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 35/4885POLB 3539/4885CYP3A4 544/4885

“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.