SCHEMBL22926342

SCHEMBL22926342

O=C(Nc1cccnc1)Nc1ccccc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 1.00
MEN1 O00255 9/20 0.72
KMT2A Q03164 9/20 0.72
MAPT P10636 5/20 0.72
POLB P06746 2/20 0.70
KDM4E B2RXH2 4/20 0.69
MAPK1 P28482 2/20 0.69
LMNA P02545 4/20 0.68
ALDH1A1 P00352 1/20 0.68
RAB9A P51151 3/20 0.66
AHR P35869 1/20 0.64
HSD17B10 Q99714 1/20 0.63
CYP11B2 P19099 1/20 0.62
NPC1 O15118 3/20 0.61
GAA P10253 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
TP53 P04637 1/20 0.60
GRIK1 P39086 1/20 0.60

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
SCHEMBL22926420 0.84 MEN1 (1.00) HTTMEN1KMT2AMAPTPOLB
SCHEMBL30051982 0.83 MEN1 (0.77) HTTMEN1KMT2AMAPTKDM4E
SCHEMBL9637653 0.83 MEN1 (0.77) HTTMEN1KMT2AMAPTKDM4E
SCHEMBL8016725 0.83 HTT (0.71) HTTMEN1KMT2AMAPTPOLB
SCHEMBL10665495 0.82 RAB9A (0.79) HTTMEN1KMT2AMAPTKDM4E
SCHEMBL1700678 0.82 MEN1 (0.87) HTTMEN1KMT2AMAPTPOLB
SCHEMBL17079604 0.82 MEN1 (0.74) HTTMEN1KMT2AMAPTKDM4E
SCHEMBL824577 0.82 KMT2A (0.69) HTTMEN1KMT2AMAPTPOLB
Bromide SCHEMBL29417998 0.82 MEN1 (0.74) HTTMEN1KMT2AMAPTKDM4E
Hydrochloric Acid SCHEMBL29388210 0.82 MEN1 (0.74) HTTMEN1KMT2AMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210022340-A1 USE OF PYRIDINE UREA COMPOUND HAVING SNAIL-KILLING ACTIVITY THE NATIONAL INSTITUTE OF PARASITIC DISEASES, CHINESE CENTER FOR DISEASE CONTROL AND PREVENTION (CN) 2021-01-28 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-20210022340-A1 USE OF PYRIDINE UREA COMPOUND HAVING SNAIL-KILLING ACTIVITY SLC14A1, UACA, UROD HTT 4212/4885MEN1 3057/4885KMT2A 4029/4885

“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.