SCHEMBL25613714

SCHEMBL25613714

COC(=O)c1ccccc1/C=N/N(C)c1nc(-c2ccccc2)c(C)s1

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 14/20 0.80
▸ ALOX5 P09917 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ GSTO1 P78417 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 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
SCHEMBL29859288 0.89 DHODH (1.00) DHODHMAPK1MEN1KMT2A
SCHEMBL19631362 0.89 DHODH (1.00) DHODHMAPK1MEN1KMT2A
SCHEMBL20836154 0.89 DHODH (1.00) DHODHMAPK1MEN1KMT2A
SCHEMBL19631370 0.81 DHODH (1.00) DHODHALDH1A1HSD17B10MAPK1MEN1
SCHEMBL20956542 0.81 DHODH (1.00) DHODHALDH1A1HSD17B10MAPK1MEN1
SCHEMBL29859659 0.81 DHODH (1.00) DHODHALDH1A1HSD17B10MAPK1MEN1
SCHEMBL25613978 0.81 DHODH (0.73) DHODHALDH1A1MAPK1GSTO1CYP1A2
SCHEMBL25614126 0.79 DHODH (0.71) DHODHALDH1A1HSD17B10MAPK1HPGD
SCHEMBL19631470 0.76 DHODH (1.00) DHODH
SCHEMBL25613706 0.75 DHODH (0.75) DHODHALDH1A1GSTO1MEN1KMT2A

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 2268/4885ALOX5 3599/4885ALDH1A1 2462/4885

“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