SCHEMBL617125

SCHEMBL617125

COc1ccc(S(=O)(=O)NCc2ccccc2OC(F)F)cc1N1CCN(C(=O)O)CC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 12/20 0.49
THRB P10828 2/20 0.49
LMNA P02545 3/20 0.47
POLB P06746 2/20 0.47
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GAA P10253 1/20 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
SCHEMBL614792 0.90 TGFBR1 (0.47) HTR6THRBLMNAPOLBMAPK1
SCHEMBL616374 0.85 HTR6 (0.54) HTR6HTTMEN1KMT2A
SCHEMBL614253 0.75 TGFBR1 (0.55) HTR6HTT
SCHEMBL614763 0.73 HTR6 (0.59) HTR6MEN1CYP1A2KMT2A
Hydrochloric Acid SCHEMBL614310 0.72 HTR6 (0.58) HTR6MEN1CYP1A2KMT2A
SCHEMBL614899 0.70 HTR6 (0.72) HTR6
Hydrochloric Acid SCHEMBL614699 0.70 HTR6 (0.71) HTR6
SCHEMBL616802 0.70 HTR6 (0.62) HTR6LMNAMEN1CYP1A2KMT2A
Hydrochloric Acid SCHEMBL617216 0.69 HTR6 (0.61) HTR6LMNAMEN1CYP1A2KMT2A
SCHEMBL3904994 0.69 KMT2A (0.68) LMNAPOLBMEN1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8343959-B2 N-phenyl-(piperazinyl or homopiperazinyl)-benzenesulfonamide or benzenesulfonyl-phenyl-(piperazine or homopiperazine) compounds suitable for treating disorders that respond to modulation of the serotonin 5-HT6 receptor ABBOTT GMBH & CO. KG (DE) 2013-01-01 US disclosed
US-20120040969-A1 N-PHENYL-(PIPERAZINYL OR HOMOPIPERAZINYL)-BENZENESULFONAMIDE OR BENZENESULFONYL-PHENYL-(PIPERAZINE OR HOMOPIPERAZINE) COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT LABORATORIES (US) 2012-02-16 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-20120040969-A1 N-PHENYL-(PIPERAZINYL OR HOMOPIPERAZINYL)-BENZENESULFONAMIDE OR BENZENESULFONYL-PHENYL-(PIPERAZINE OR HOMOPIPERAZINE) COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR HTR6, HTR5A, HTR2A HTR6 1/4885THRB 1583/4885LMNA 4017/4885

“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.