SCHEMBL23346372

SCHEMBL23346372

CCNC(=O)c1ccc(/N=N/c2cc(CCN)ccc2O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
TDP1 Q9NUW8 3/20 0.41
NME4 O00746 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
CHRM1 P11229 1/20 0.41
ADORA2A P29274 1/20 0.41
AVPR2 P30518 1/20 0.41
AGTR1 P30556 1/20 0.41
SLC6A4 P31645 1/20 0.41
AVPR1A P37288 1/20 0.41
HTR3A P46098 1/20 0.41
GCDH Q92947 1/20 0.41
SLC29A1 Q99808 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40

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
SCHEMBL21786995 0.84 HTT (0.43) CA1CA2TDP1NME4ADORA3
SCHEMBL21786993 0.83 CA1 (0.46) BACE1CA1CA2TDP1MAPK1
SCHEMBL13523477 0.78 CA1 (0.46) CA1CA2THRBALDH1A1TP53
SCHEMBL24346426 0.77 HTT (0.46) CA1CA2TDP1NME4ADORA3
Hydrochloric Acid SCHEMBL20771828 0.77 PLK1 (0.54) CA1CA2TDP1CA9TAAR1
SCHEMBL22108057 0.75 CA1 (0.43) CA1CA2TDP1THRBMAPK1
SCHEMBL8609862 0.74 TRPV1 (0.50) THRBKDM4E
SCHEMBL26324657 0.74 HPGD (0.49) CA1CA2TDP1NME4ADORA3
SCHEMBL17430663 0.73 POLB (0.38) SIRT5THRBMAPK1MAPTKDM4E
SCHEMBL23734235 0.73 MAPT (0.45) BACE1TDP1MAPK1TAAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230374582-A1 METHOD COMPRISING LIGHT-EMITTING MARKER SUMITOMO CHEMICAL CO., LTD. (JP) 2023-11-23 US disclosed
WO-2022079005-A1 METHOD COMPRISING LIGHT EMITTING MARKER CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2022-04-21 WO disclosed
US-20210139976-A1 NUCLEOTIDE ANALOGUES AND USE THEREOF FOR NUCLEIC ACID SEQUENCING AND ANALYSIS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2021-05-13 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-20210139976-A1 NUCLEOTIDE ANALOGUES AND USE THEREOF FOR NUCLEIC ACID SEQUENCING AND ANALYSIS NUDT1, NT5C3B, RNGTT BACE1 4717/4885CA1 4780/4885CA2 4691/4885

“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.