SCHEMBL116544

SCHEMBL116544

Cc1ccc(N)cc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.54
SMARCA2 P51531 1/20 0.51
SMARCA4 P51532 1/20 0.51
PBRM1 Q86U86 1/20 0.51
MAPT P10636 3/20 0.49
LMNA P02545 3/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 3/20 0.48
MAP4K4 O95819 1/20 0.46
TSHR P16473 1/20 0.46
KIT P10721 1/20 0.46
GPR119 Q8TDV5 4/20 0.45
GAA P10253 1/20 0.44
ALOX12 P18054 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL29569426 0.89 NR1H2 (0.54) NR1H2SMARCA2SMARCA4PBRM1MAPT
SCHEMBL5383294 0.89 NR1H2 (0.54) NR1H2SMARCA2SMARCA4PBRM1MAPT
SCHEMBL30998086 0.85 NR1H2 (0.53) NR1H2SMARCA2SMARCA4PBRM1MAPT
SCHEMBL1613019 0.85 NR1H2 (0.53) NR1H2SMARCA2SMARCA4PBRM1MAPT
SCHEMBL30962717 0.85 MAPT (0.56) NR1H2SMARCA2SMARCA4PBRM1MAPT
SCHEMBL10126918 0.85 MAPT (0.56) NR1H2SMARCA2SMARCA4PBRM1MAPT
SCHEMBL1611981 0.84 NR1H2 (0.52) NR1H2SMARCA2SMARCA4PBRM1MAPT
SCHEMBL15114426 0.84 MAPT (0.49) SMARCA2SMARCA4PBRM1MAPTLMNA
SCHEMBL29508821 0.84 MAPT (0.55) NR1H2SMARCA2SMARCA4PBRM1MAPT
SCHEMBL993225 0.84 MAPT (0.55) NR1H2SMARCA2SMARCA4PBRM1MAPT

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-8183237-B2 Benzenesulfonanilide compounds suitable for treating disorders that respond to modulation of the serotonin 5-HT6 receptor ABBOTT LABORATORIES (US) 2012-05-22 US disclosed
EP-2424844-A1 BENZENESULFONANILIDE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR Abbott GmbH & Co. KG (DE) 2012-03-07 EP disclosed
US-20100292221-A1 BENZENESULFONANILIDE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2010-11-18 US disclosed
WO-2010125135-A1 BENZENESULFONANILIDE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2010-11-04 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-20100292221-A1 BENZENESULFONANILIDE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR HTR6, HTR1D, HTR4 NR1H2 1489/4885SMARCA2 4316/4885SMARCA4 4024/4885

“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.