SCHEMBL25613837

SCHEMBL25613837

Cc1ccccc1/C=N/Nc1nc(-c2cccc(C(=O)NN)c2)cs1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.56
▸ MAOA P21397 1/20 0.52
▸ MAOB P27338 1/20 0.52
▸ GAA P10253 3/20 0.51
▸ MGAM O43451 1/20 0.51
▸ SI P14410 1/20 0.51
▸ MGAM2 Q2M2H8 1/20 0.51
▸ MAPT P10636 5/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ GUSB P08236 5/20 0.48
▸ KDM4E B2RXH2 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ MAPK1 P28482 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45

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
SCHEMBL25614224 0.90 DHODH (0.58) DHODHMAOAMAOBGAAMGAM
SCHEMBL25613768 0.82 GAA (0.68) DHODHMAOAMAOBGAAMGAM
SCHEMBL25613885 0.80 GAA (0.72) DHODHMAOAMAOBGAAMGAM
SCHEMBL25613829 0.80 MAOA (0.58) DHODHMAOAMAOBGAAMGAM
SCHEMBL25613862 0.78 GUSB (0.67) DHODHMAOAMAOBGAAMGAM
SCHEMBL28187401 0.77 DHODH (0.78) DHODHMAOAMAOBGAAMGAM
SCHEMBL19631409 0.77 DHODH (0.78) DHODHMAOAMAOBGAAMGAM
SCHEMBL11091594 0.76 MAPT (0.48) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL25613755 0.75 DHODH (0.56) DHODHMAOAMAOBGAAMGAM
SCHEMBL11091588 0.72 MAPT (0.55) GAAMAPTMEN1KMT2AALDH1A1

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-20230190713-A1 ANTI-RNA VIRUS DRUG AND APPLICATION THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2023-06-22 — — 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-20230190713-A1 ANTI-RNA VIRUS DRUG AND APPLICATION THEREOF SARS1, EIF2AK2, NSUN3 DHODH 2268/4885MAOA 4585/4885MAOB 4626/4885

“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.

Send feedback