SCHEMBL218331

SCHEMBL218331

c1nnnn1-c1nnn[nH]1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.41
MAPT P10636 2/20 0.38
F2 P00734 1/20 0.38
KCNJ1 P48048 8/20 0.37
ALDH1A1 P00352 4/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL29118314 0.98 NOTUM (0.39) NOTUMMAPTF2KCNJ1ALDH1A1
Guanidine SCHEMBL7865811 0.89 MAPT (0.40) NOTUMMAPTF2KCNJ1ALDH1A1
SCHEMBL29224572 0.78 L3MBTL1 (0.38) NOTUMMAPTALDH1A1LMNAHTT
SCHEMBL8688771 0.69 KDM4E (0.35) ALDH1A1
SCHEMBL19856445 0.65 KCNJ1 (0.40) NOTUMMAPTF2KCNJ1ALDH1A1
SCHEMBL29710932 0.65 NOTUM (0.39) NOTUMMAPTF2KCNJ1ALDH1A1
SCHEMBL29220900 0.65 NOTUM (0.39) NOTUMMAPTF2KCNJ1ALDH1A1
SCHEMBL2289284 0.62 NOTUM (0.52) NOTUMMAPTF2KCNJ1ALDH1A1
SCHEMBL9466419 0.62 NPC1 (0.33)
Hydrochloric Acid SCHEMBL29238578 0.61 ALDH1A1 (0.47) NOTUMMAPTF2ALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116925004-A N10 chain-containing gas generating agent and synthesis method thereof 南京理工大学 2023-10-24 CN claimed
US-20230322180-A1 COMPRESSED PROPELLANT ELEMENT, METHOD OF MANUFACTURE THEREOF AND GAS GENERATOR COMPRISING PROPELLANT ELEMENT ZF AIRBAG GERMANY GMBH (DE) 2023-10-12 US claimed
US-20230219866-A1 GAS GENERATING COMPOSITIONS AND METHODS OF USING DEUTSCHE BANK TRUST COMPANY AMERICAS 2023-07-13 US claimed
EP-2592073-B1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND THEIR USE AERPIO THERAPEUTICS INC (US) 2017-08-30 EP claimed
US-9045380-B1 Gas generating compositions TK HOLDINGS INC. (US) 2015-06-02 US claimed
US-8895563-B2 Human protein tyrosine phosphatase inhibitors and methods of use AERPIO THERAPEUTICS, INC. (US) 2014-11-25 US claimed
EP-2041102-B1 Human protein tyrosine phosphatase inhibitors and methods of use AERPIO THERAPEUTICS INC (US) 2014-11-12 EP claimed
US-20140249100-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR PREVENTING METASTASIS OF CANCER CELLS AERPIO THERAPEUTICS INC. (US) 2014-09-04 US claimed
EP-2624916-A2 COMPOSITIONS AND METHODS FOR TREATING OCULAR EDEMA, NEOVASCULARIZATION AND RELATED DISEASES Aerpio Therapeutics Inc. (US) 2013-08-14 EP claimed
EP-2592073-A2 Human protein tyrosine phosphatase inhibitors and their use Warner Chilcott Company, LLC (PR) 2013-05-15 EP claimed
WO-2008002570-A2 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THE PROCTER & GAMBLE COMPANY (US) 2008-01-03 WO claimed
US-20070299116-A1 {4-[2-(5-methyl-[1,3,4]thiadiazol-2-ylamino)-2-(4-phenylthiazol-2-yl)-ethyl]phenyl}sulfamic acid; anticarcinogenic, antitumor, antidiabrtic agent; angiogenesis inhibitor; sarcoid, syphilis, Paget's disease, vein occlusion, artery occlusion, carotid obstructive disease, chronic uveitis/vitritis THE PROCTER & GAMBLE COMPANY (US) 2007-12-27 US claimed
US-20070181236-A1 Gas-generating pyrotechnical compositions and pyrotechnical compounds for automotive safety SNPE MATERIAUX ENERGETIQUES (FR) 2007-08-09 US claimed
EP-1713745-A2 GAS-GENERATING PYROTECHNICAL COMPOSITIONS AND PYROTECHNICAL COMPOUNDS FOR AUTOMOTIVE SAFETY SNPE Matériaux Energétiques (FR) 2006-10-25 EP claimed
WO-2005077862-A2 GAS-GENERATING PYROTECHNICAL COMPOSITIONS AND PYROTECHNICAL COMPOUNDS FOR AUTOMOTIVE SAFETY SNPE MATERIAUX ENERGETIQUES (FR) 2005-08-25 WO claimed
EP-1003696-B1 IGNITION ENHANCEMENT COMPOSITION FOR AN AIRBAG INFLATOR KEY SAFETY SYSTEMS INC (US) 2005-03-30 EP claimed
US-6300498-B1 Substituted ammonium salt of 1,5′-bitetrazole TOYO KASEI KOGYO COMPANY LIMITED (JP) 2001-10-09 US claimed
EP-1003696-A4 IGNITION ENHANCEMENT COMPOSITION FOR AN AIRBAG INFLATOR BREED AUTOMOTIVE TECH (US) 2000-09-13 EP claimed
EP-1003696-A1 IGNITION ENHANCEMENT COMPOSITION FOR AN AIRBAG INFLATOR Breed Automotive Technology, Inc. (US) 2000-05-31 EP claimed
WO-1999008983-A1 IGNITION ENHANCEMENT COMPOSITION FOR AN AIRBAG INFLATOR BREED AUTOMOTIVE TECHNOLOGY, INC. (US) 1999-02-25 WO claimed

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-20070299116-A1 {4-[2-(5-methyl-[1,3,4]thiadiazol-2-ylamino)-2-(4-phenylthiazol-2-yl)-ethyl]phenyl}sulfamic acid; anticarcinogenic, antitumor, antidiabrtic agent; angiogenesis inhibitor; sarcoid, syphilis, Paget's disease, vein occlusion, artery occlusion, carotid obstructive disease, chronic uveitis/vitritis DUSP15, PPP5C, DUSP1 NOTUM 3923/4885MAPT 436/4885F2 4816/4885
US-20140249100-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR PREVENTING METASTASIS OF CANCER CELLS EPCAM, CD44, CDH1 NOTUM 1289/4885MAPT 4288/4885F2 1860/4885

“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.