SCHEMBL432450

SCHEMBL432450

C=CC(=O)NC(C)(C)CCC(=O)c1ncc[nH]1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35

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
SCHEMBL432102 0.83 NPC1 (0.37) KMT2ANPC1RAB9A
SCHEMBL1883966 0.80 TBXAS1 (0.43) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL7052930 0.76 ALDH1A1 (0.36) ALDH1A1KMT2ANPC1RAB9A
SCHEMBL6314871 0.74 ZDHHC20 (0.41) ALDH1A1KMT2ANPC1RAB9A
SCHEMBL2424004 0.72 NPC1 (0.45) ALDH1A1KMT2ANPC1RAB9A
SCHEMBL1237700 0.71 NPC1 (0.43) ALDH1A1KMT2ANPC1RAB9A
SCHEMBL5057263 0.70 ALDH1A1 (0.51) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL7574578 0.70 NPC1 (0.46) ALDH1A1KMT2ANPC1RAB9A
SCHEMBL8736180 0.69 TBXAS1 (0.47) ALDH1A1KMT2ANPC1RAB9A
SCHEMBL29163121 0.69 NPC1 (0.47) ALDH1A1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582684-B2 Macroporous ion exchange resins 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-09-01 US claimed
US-20050014027-A1 Crosslinked polymer doped with iron oxide; diagnosis of nucleic acids BAYER AKTIENGESELLSCHAFT (DE) 2005-01-20 US claimed
US-20250367610-A1 Block Copolymers Grafted to Porous Polymeric Substrate SOLVENTUM INTELLECTUAL PROPERTIES COMPANY (US) 2025-12-04 US disclosed
EP-4543575-A1 BLOCK COPOLYMERS GRAFTED TO POROUS POLYMERIC SUBSTRATE Solventum Intellectual Properties Company (US) 2025-04-30 EP disclosed
EP-2588219-B1 FILTER PLATE ARTICLE HAVING A WATER-ABSORBENT FILTER ASSEMBLY NEOGEN FOOD SAFETY US HOLDCO CORP (US) 2024-05-29 EP disclosed
WO-2023248020-A1 BLOCK COPOLYMERS GRAFTED TO POROUS POLYMERIC SUBSTRATE 3M INNOVATIVE PROPERTIES COMPANY (US) 2023-12-28 WO disclosed
EP-2376689-B1 FUNCTIONALIZED NONWOVEN ARTICLE 3M INNOVATIVE PROPERTIES CO (US) 2023-09-13 EP disclosed
US-11279731-B2 Ligand functional substrates 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-03-22 US disclosed
EP-3326711-B1 GRAFT COPOLYMER FUNCTIONALIZED ARTICLE 3M INNOVATIVE PROPERTIES CO (US) 2021-07-07 EP disclosed
US-10988827-B2 Coalescing elements in copper production 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-04-27 US disclosed
EP-3255085-B1 LIGAND GRAFT FUNCTIONALIZED SUBSTRATES 3M INNOVATIVE PROPERTIES CO (US) 2020-06-10 EP disclosed
US-20070154703-A1 FUNCTIONALIZED SUBSTRATES 3M INNOVATIVE PROPERTIES COMPANY 2007-07-05 US disclosed
WO-2007075442-A2 METHOD OF MAKING MACROPOROUS ANION EXCHANGE RESINS 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-07-05 WO disclosed
US-20070142590-A1 Method of making macroporous anion exchange resins 3M INNOVATIVE PROPERTIES COMPANY 2007-06-21 US disclosed
US-7098253-B2 particles of hydrophilic, crosslinked copolymers of N,N'-alkylenebis(meth)acrylamide and a sulfonated N,N'-alkylene bisacrylic amide; chromatographic columns, composite materials, filters; large furface area, ease of manufacture, low material cost, variety of fiber texture, densities 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-08-29 US disclosed
US-20050261384-A1 MACROPOROUS ION EXCHANGE RESINS 3M INNOVATIVE PROPERTIES COMPANY 2005-11-24 US disclosed
US-20050261385-A1 Macroporous ion exchange resins 3M INNOVATIVE PROPERTIES COMPANY 2005-11-24 US disclosed
US-20050014027-A1 Crosslinked polymer doped with iron oxide; diagnosis of nucleic acids BAYER AKTIENGESELLSCHAFT (DE) 2005-01-20 US disclosed
US-6590094-B2 Methacrylate resin for use as tool in genetic analysis BAYER AKTIENGESELLSCHAFT (DE) 2003-07-08 US disclosed
US-20020106659-A1 Methacrylate resin for use as tool in genetic analysis BAYER AKTIENGESELLSCHAFT (DE) 2002-08-08 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 (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-11279731-B2 Ligand functional substrates PCNA, POLM, POLL ALDH1A1 4565/4885CYP3A4 4323/4885CYP2C9 4616/4885

“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.