SCHEMBL228320

SCHEMBL228320

N#CNc1ccccc1.[Ag]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.43
TDP1 Q9NUW8 4/20 0.43
HSD17B10 Q99714 3/20 0.43
CTSD P07339 1/20 0.43
TSHR P16473 4/20 0.41
PTGS2 P35354 2/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
MAPK1 P28482 1/20 0.41
HTR2B P41595 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
IDO1 P14902 2/20 0.39
LMNA P02545 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
Water SCHEMBL11606806 0.97 ALDH1A1 (0.45) ALDH1A1TDP1HSD17B10CTSDTSHR
SCHEMBL1259441 0.97
Water SCHEMBL11606809 0.97 ALDH1A1 (0.45) ALDH1A1TDP1HSD17B10CTSDTSHR
Benzene SCHEMBL28295973 0.97 ALDH1A1 (0.45) ALDH1A1TDP1HSD17B10CTSDTSHR
SCHEMBL28530865 0.94 ALDH1A1 (0.43) ALDH1A1TDP1HSD17B10CTSDTSHR
Hydrochloric Acid SCHEMBL27825197 0.94 ALDH1A1 (0.43) ALDH1A1TDP1HSD17B10CTSDTSHR
Hydrogen Sulfide SCHEMBL28113733 0.94 ALDH1A1 (0.43) ALDH1A1TDP1HSD17B10CTSDTSHR
SCHEMBL9853603 0.94 ALDH1A1 (0.43) ALDH1A1TDP1HSD17B10CTSDTSHR
SCHEMBL5026944 0.82 DHODH (0.43) ALDH1A1TDP1HSD17B10MAPK1CYP3A4
SCHEMBL8985134 0.82 ALDH1A1 (0.32) ALDH1A1CYP1A2MAPT

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
EP-2346973-B1 WASHING, CLEANING, POST-TREATING OR AUXILIARY WASHING AGENT CONTAINING SILVER HENKEL AG & CO KGAA (DE) 2017-12-06 EP claimed
EP-2408889-B1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO KGAA (DE) 2012-12-26 EP claimed
EP-2408888-B1 WASHING AID HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO KGAA (DE) 2012-11-14 EP claimed
US-8309506-B2 Washing aid having an antibacterial effect HENKEL AG & CO. KGAA (DE) 2012-11-13 US claimed
US-20120003326-A1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO. KGAA (DE) 2012-01-05 US claimed
US-20120003289-A1 WASHING AID HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO. KGAA (DE) 2012-01-05 US claimed
US-20110224120-A1 WASHING, CLEANING, POST-TREATING OR AUXILIARY WASHING AGENT CONTAINING SILVER HENKEL AG & CO. KGAA (DE) 2011-09-15 US claimed
US-8309506-B2 Washing aid having an antibacterial effect HENKEL AG & CO. KGAA (DE) 2012-11-13 US disclosed
US-20120003326-A1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO. KGAA (DE) 2012-01-05 US disclosed
US-20120003289-A1 WASHING AID HAVING AN ANTIBACTERIAL EFFECT HENKEL AG & CO. KGAA (DE) 2012-01-05 US disclosed
US-20110224120-A1 WASHING, CLEANING, POST-TREATING OR AUXILIARY WASHING AGENT CONTAINING SILVER HENKEL AG & CO. KGAA (DE) 2011-09-15 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-20120003326-A1 DETERGENT, CLEANING AGENT, AFTERTREATMENT AGENT, OR WASHING AID CONTAINING ALDEHYDES AND HAVING AN ANTIBACTERIAL EFFECT CAT, GPX4, WASHC4 ALDH1A1 33/4885TDP1 2308/4885HSD17B10 684/4885

“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.