SCHEMBL644276

SCHEMBL644276

COC(=O)c1cccc(CN(C)S(=O)(=O)c2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.49
ABL1 P00519 1/20 0.47
RIN1 Q13671 1/20 0.47
RAB9A P51151 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HSD17B1 P14061 1/20 0.47
HSD17B2 P37059 1/20 0.47
LOXL2 Q9Y4K0 1/20 0.47
MAPT P10636 4/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46
LMNA P02545 3/20 0.46

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
SCHEMBL646717 0.87 ABL1 (0.53) ABL1RIN1ALDH1A1HSD17B1HSD17B2
SCHEMBL3877752 0.84 PLAU (0.54) RAB9AHSD17B1HSD17B2LOXL2MEN1
SCHEMBL3883761 0.83 HSD17B1 (0.60) RAB9AALDH1A1HSD17B1HSD17B2LOXL2
SCHEMBL3872847 0.81 TP53 (0.48) RAB9AALDH1A1LOXL2MAPTCYP1A2
SCHEMBL12863703 0.77 TP53 (0.61) MAPTMEN1KMT2ASMN1; SMN2TP53
SCHEMBL4490305 0.75 LOXL2 (0.52) RAB9AALDH1A1LOXL2MAPTNPC1
SCHEMBL165622 0.74 LOXL2 (0.66) RAB9AALDH1A1LOXL2MAPTMEN1
SCHEMBL8247553 0.74 KMT2A (0.51) RAB9AALDH1A1LOXL2MAPTCYP1A2
SCHEMBL3881039 0.74 POLB (0.57) RAB9AALDH1A1MAPTMEN1KMT2A
SCHEMBL7413611 0.73 TAS2R14 (0.68) MAPTLMNASMN1; SMN2TP53ADAM10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119633-B2 N-{2-[2-(4-benzyl-4-hydroxy-piperidin-1-yl)-2-oxo-ethoxy]-ethyl}-N-ethyl-4-methoxy-2,3,6-trimethyl-phenylsulfonamide; condensing the N-carboxyalkyl phenylsulfonamide with the substituted piperidine; bradykinin receptor antagonists; analgesics; antidiabetics; angiogenesis inhibitors; rheumatic diseases GRUENENTHAL GMBH (DE) 2012-02-21 US disclosed
EP-2150530-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2011-10-26 EP disclosed
EP-2150530-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-02-10 EP disclosed
US-20080312231-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-12-18 US disclosed
WO-2008131947-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2008-11-06 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-20080312231-A1 Substituted Sulfonamide Compounds SULT2A1, SULT1A1, SCN1A USP2 3417/4885ABL1 376/4885RIN1 3558/4885

“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.