SCHEMBL4668674

SCHEMBL4668674

Cc1ccc(S(=O)(=O)NC2CCCCNC2=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.56
ALDH1A1 P00352 4/20 0.56
TSHR P16473 2/20 0.56
CYP3A4 P08684 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
ATM Q13315 1/20 0.46
KDM4E B2RXH2 1/20 0.45
RECQL P46063 1/20 0.45
BACE1 P56817 1/20 0.45
NPC1 O15118 1/20 0.44
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
ADORA3 P0DMS8 1/20 0.43

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
SCHEMBL15172491 1.00 RAB9A (0.56) RAB9AALDH1A1TSHRCYP3A4SMN1; SMN2
SCHEMBL14856021 0.96 ALDH1A1 (0.54) RAB9AALDH1A1TSHRCYP3A4SMN1; SMN2
SCHEMBL14855597 0.96 ALDH1A1 (0.54) RAB9AALDH1A1TSHRCYP3A4SMN1; SMN2
SCHEMBL5568155 0.86 MAPK1 (0.56) RAB9AALDH1A1SMN1; SMN2KDM4ERECQL
SCHEMBL2399329 0.86 MMP2 (0.51) ALDH1A1SMN1; SMN2KDM4ERECQLPSEN1
SCHEMBL5518996 0.86 MMP2 (0.51) ALDH1A1SMN1; SMN2KDM4ERECQLPSEN1
SCHEMBL5568161 0.86 MAPK1 (0.56) RAB9AALDH1A1SMN1; SMN2KDM4ERECQL
SCHEMBL1876072 0.86 ALDH1A1 (0.51) RAB9AALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL1877899 0.86 ALDH1A1 (0.51) RAB9AALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL14855976 0.85 BACE1 (0.47) RAB9AALDH1A1SMN1; SMN2LMNAKDM4E

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5672598-A MATRIX METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1997-09-30 US claimed
US-10613105-B2 Competitive immunoassay test system for detecting a pyrogen FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2020-04-07 US disclosed
EP-3020824-B1 COMPETITIVE IMMUNOASSAY TEST SYSTEM FOR DETECTING A PYROGEN FRAUNHOFER GES FORSCHUNG (DE) 2017-11-08 EP disclosed
US-20160327580-A1 COMPETITIVE IMMUNOASSAY TEST SYSTEM FOR DETECTING A PYROGEN FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2016-11-10 US disclosed
EP-3020824-A1 COMPETITIVE IMMUNOASSAY TEST SYSTEM FOR DETECTING A PYROGEN Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2016-05-18 EP disclosed
US-20130203734-A1 ANTI-INFLAMMATORY AGENTS GRAINGER DAVID JOHN (GB) 2013-08-08 US disclosed
EP-1496877-B1 METHOD AND COMPOSITION FOR TREATMENT OF DIABETES, HYPERTENSION, CHRONIC HEART FAILURE AND FLUID RETENTIVE STATES NOVO NORDISK AS (DK) 2008-10-01 EP disclosed
EP-1404675-B1 DPP-IV-INHIBITING PURINE DERIVATIVES FOR THE TREATMENT OF DIABETES NOVO NORDISK AS (DK) 2008-03-12 EP disclosed
US-20070197552-A1 Method and composition for treatment of diabetes, hypertension, chronic heart failure and fluid retentive states NOVO NORDISK A/S (DK) 2007-08-23 US disclosed
US-7192952-B2 Heterocyclic compounds that are inhibitors of the enzyme DPP-IV NOVO NORDISK, A/S (DK) 2007-03-20 US disclosed
EP-1404675-A1 DPP-IV-INHIBITING PURINE DERIVATIVES FOR THE TREATMENT OF DIABETES NOVO NORDISK A/S (DK) 2004-04-07 EP disclosed
US-20030236272-A1 Method and composition for treatment of diabetes, hypertension, chronic heart failure and fluid retentive states NOVO NORDISK A/S (DK) 2003-12-25 US disclosed
EP-0815084-B1 LACTAM-CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEASE PROCTER & GAMBLE (US) 2003-08-27 EP disclosed
WO-2003057200-A2 COMPOSITIONS COMPRISING INHIBITORS OF DPP-IV AND NEP ENZYMES FOR THE TREATMENT OF DIABETES NOVO NORDISK A/S (DK) 2003-07-17 WO disclosed
US-20030105077-A1 Heterocyclic compounds that are inhibitors of the enzyme DPP-IV NOVO NORDISK A/S (DK) 2003-06-05 US disclosed
WO-2003004496-A1 DPP-IV-INHIBITING PURINE DERIVATIVES FOR THE TREATMENT OF DIABETES NOVO NORDISK A/S (DK) 2003-01-16 WO disclosed
US-5672598-A MATRIX METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1997-09-30 US disclosed
US-5527777-A TREATMENT OF PROSTATE CANCER, ANTIFERTILITY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1996-06-18 US disclosed
EP-0668874-A1 LHRH ANTAGONISTS AND INTERMEDIATE PRODUCTS SCHERING AKTIENGESELLSCHAFT (DE) 1995-08-30 EP disclosed
WO-1992020711-A2 LHRH ANTAGONISTS AND INTERMEDIATE PRODUCTS SCHERING AKTIENGESELLSCHAFT (DE) 1992-11-26 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 (4 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-20130203734-A1 ANTI-INFLAMMATORY AGENTS IL6, TNF, IL1B RAB9A 3261/4885ALDH1A1 178/4885TSHR 4649/4885
US-20030105077-A1 Heterocyclic compounds that are inhibitors of the enzyme DPP-IV DPP4, DPP7, DPP3 RAB9A 4471/4885ALDH1A1 55/4885TSHR 3634/4885
US-20030236272-A1 Method and composition for treatment of diabetes, hypertension, chronic heart failure and fluid retentive states DPP4, GIPR, GLP1R RAB9A 2919/4885ALDH1A1 2283/4885TSHR 918/4885
US-20070197552-A1 Method and composition for treatment of diabetes, hypertension, chronic heart failure and fluid retentive states DPP4, GIPR, GLP1R RAB9A 2919/4885ALDH1A1 2283/4885TSHR 918/4885

“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.