SCHEMBL2405877

SCHEMBL2405877

CC(=O)c1ccc(S(=O)(=O)NC2CCC(C(=O)N3CCN(C4CCC4)CC3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.58
MEN1 O00255 5/20 0.58
ALDH1A1 P00352 8/20 0.50
MAPT P10636 1/20 0.50
LMNA P02545 4/20 0.46
THRB P10828 1/20 0.46
TSHR P16473 1/20 0.46
BLM P54132 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 2/20 0.42
HTT P42858 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL2405879 1.00 KMT2A (0.58) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL2400630 0.98 KMT2A (0.61) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL2400636 0.98 KMT2A (0.61) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL2401122 0.89 ALDH1A1 (0.50) KMT2AMEN1ALDH1A1SMN1; SMN2POLB
SCHEMBL2401119 0.89 ALDH1A1 (0.50) KMT2AMEN1ALDH1A1SMN1; SMN2POLB
SCHEMBL27750512 0.88 ALDH1A1 (0.57) KMT2AMEN1ALDH1A1LMNATSHR
SCHEMBL2404164 0.88 ALDH1A1 (0.57) KMT2AMEN1ALDH1A1LMNATSHR
SCHEMBL2402205 0.87 ALDH1A1 (0.50) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL2402209 0.87 ALDH1A1 (0.50) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL2402269 0.84 HRH3 (0.53) KMT2AMEN1ALDH1A1THRBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017773-B2 Cyclohexyl sulfonamide derivatives HOFFMANN-LA ROCHE INC. (US) 2011-09-13 US disclosed
EP-1979322-B1 CYCLOHEXYL SULFONAMIDE DERIVATIVES HAVING H3 RECEPTOR ACTIVITY HOFFMANN LA ROCHE (CH) 2010-09-01 EP disclosed
US-20100120791-A1 CYCLOHEXYL SULFONAMIDE DERIVATIVES NETTEKOVEN MATTHIAS 2010-05-13 US disclosed
EP-1979322-A1 CYCLOHEXYL SULFONAMIDE DERIVATIVES HAVING H3 RECEPTOR ACTIVITY F.HOFFMANN-LA ROCHE AG (CH) 2008-10-15 EP disclosed
WO-2007082840-A1 CYCLOHEXYL SULFONAMIDE DERIVATIVES HAVING H3 RECEPTOR ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 2007-07-26 WO disclosed
US-20070173511-A1 Cyclohexyl sulfonamide derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-07-26 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 (2 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-20100120791-A1 CYCLOHEXYL SULFONAMIDE DERIVATIVES HRH3, HRH4, HRH1 KMT2A 338/4885MEN1 3462/4885ALDH1A1 430/4885
US-20070173511-A1 Cyclohexyl sulfonamide derivatives HRH3, HRH4, HRH1 KMT2A 338/4885MEN1 3462/4885ALDH1A1 430/4885

“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.