SCHEMBL26074079

SCHEMBL26074079

COCc1cccc(-c2ccc(-c3cc(C=O)c4cc(F)ccc4n3)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 10/20 0.46
▸ ERN1 O75460 1/20 0.46
▸ BACE1 P56817 1/20 0.42
▸ PLA2G2A P14555 3/20 0.42
▸ AGXT P21549 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL26074076 0.88 DHODH (0.48) DHODHERN1BACE1PLA2G2AAGXT
SCHEMBL29617653 0.84 DHODH (0.69) DHODHPLA2G2A
SCHEMBL23590251 0.84 DHODH (0.69) DHODHPLA2G2A
SCHEMBL26075388 0.80 DHODH (0.43) DHODHERN1BACE1L3MBTL1
SCHEMBL26075570 0.79 DHODH (0.46) DHODHPLA2G2A
SCHEMBL26649544 0.78 PLA2G2A (0.65) DHODHPLA2G2A
SCHEMBL26075305 0.77 DHODH (0.41) DHODHPLA2G2A
SCHEMBL26074084 0.77 DHODH (0.66) DHODHERN1PLA2G2A
SCHEMBL26074069 0.77 DHODH (0.49) DHODHPLA2G2A
SCHEMBL23590206 0.77 KDM4E (0.50) DHODHERN1PLA2G2A

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-20230303710-A1 METHODS AND COMPOSITIONS FOR INHIBITION OF DIHYDROOROTATE DEHYDROGENASE IN COMBINATION WITH AN ANTI-CD38 THERAPEUTIC AGENT OHIO STATE INNOVATION FOUNDATION (US) 2023-09-28 — — 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-20230303710-A1 METHODS AND COMPOSITIONS FOR INHIBITION OF DIHYDROOROTATE DEHYDROGENASE IN COMBINATION WITH AN ANTI-CD38 THERAPEUTIC AGENT DHODH, CD38, DPYD DHODH 1/4885ERN1 3300/4885BACE1 2291/4885

“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.

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