SCHEMBL7267804

SCHEMBL7267804

NCCCN.NCCCN

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.75
DNM1 Q05193 5/20 0.67
CA12 O43570 3/20 0.67
CA2 P00918 3/20 0.67
CA4 P22748 3/20 0.67
CA6 P23280 3/20 0.67
CA5A P35218 3/20 0.67
CA7 P43166 3/20 0.67
CA9 Q16790 3/20 0.67
CA14 Q9ULX7 3/20 0.67
CA5B Q9Y2D0 3/20 0.67
CA1 P00915 2/20 0.67
CA3 P07451 2/20 0.67
TSHR P16473 2/20 0.67
LMNA P02545 1/20 0.67
BLM P54132 1/20 0.67
CASP2 P42575 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
F13A1 P00488 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
SCHEMBL16345592 1.00 NFKB1 (0.75) NFKB1DNM1CA12CA2CA4
SCHEMBL8182 1.00
Bromide SCHEMBL4384610 0.94
Hydrochloric Acid SCHEMBL423991 0.94
Hydrochloric Acid SCHEMBL158471 0.94
SCHEMBL25350595 0.94
SCHEMBL11042280 0.94
Water SCHEMBL7051853 0.94
Fluoride SCHEMBL21296519 0.94
Water SCHEMBL11771535 0.94 NFKB1 (0.67) NFKB1DNM1CA12CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105936824-A Soil heavy metal activator and preparation method and application thereof 深圳多元拓展环保科技有限公司 2016-09-14 CN claimed
CN-113274506-A Drug delivery technology of polymer-carbohydrate conjugates 念·吴 2021-08-20 CN disclosed
EP-3065547-A1 BISCATIONIC AND TRISCATIONIC AMPHILES AS ANTIMICROBIAL AGENTS Temple University Of The Commonwealth System Of Higher Education (US) 2016-09-14 EP disclosed
WO-2015069760-A1 BISCATIONIC AND TRISCATIONIC AMPHILES AS ANTIMICROBIAL AGENTS TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2015-05-14 WO disclosed
US-6646093-B2 Extruding auxiliary for cement materials, a mortar thickening agent, an underwater concrete thickening agent, a ceramics forming binder and a moisturizer for hair cosmetics; water and shape retention. MITSUI CHEMICALS, INC. (JP) 2003-11-11 US disclosed
CN-1445252-A Conjugated alkadiene polymer rubbers with no-color and low gelatin and its preparing method INST OF YANSHAN PETROCHEMICAL (CN) 2003-10-01 CN disclosed
US-20020045724-A1 Water-souluble polyurthane having comb-shaped hydrophobic group and application thereof MITSUI TAKEDA CHEMICALS, INC. (JP) 2002-04-18 US disclosed
WO-2001000629-A1 MANUFACTURE OF ZINC HEXASULFIDE AMINE COMPLEXES FLEXSYS AMERICA L.P. (US) 2001-01-04 WO disclosed
US-6077329-A ADDING SOLUTION OF ALANE-AMINE ADDUCT DISSOLVED IN ORGANIC SOLVENT TO CATALYST-CONTAINING SOLUTION HEATED TO REACTION TEMPERATURE TO DECOMPOSE ALANE INTO ALUMINUM POWDER THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2000-06-20 US disclosed
US-5885321-A CATALYTIC DECOMPLEXING AND REDUCTION TO PRECIPITATE ALUMINUM METAL FROM SOLUTION OF COMPLEXED ALUMINUM HYDRIDE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1999-03-23 US disclosed
US-4046747-A Additive for improving the adhesion to textiles of hot melt adhesives based on copolyamides CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DT) 1977-09-06 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-20020045724-A1 Water-souluble polyurthane having comb-shaped hydrophobic group and application thereof BMI1, ASH2L, HAT1 NFKB1 4405/4885DNM1 4078/4885CA12 792/4885

“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.