SCHEMBL26075602

SCHEMBL26075602

COC(=O)c1cc(-c2ccc(-c3ccc(Oc4ccccc4)cc3)cc2)nc2ccc(C(F)(F)F)cc12

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 7/20 0.62
▸ DHODH Q02127 6/20 0.58
▸ KDM4E B2RXH2 1/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ MAPT P10636 4/20 0.53
▸ RUVBL1 Q9Y265 1/20 0.53
▸ ACP1 P24666 1/20 0.51

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
SCHEMBL23590240 0.89 DHODH (0.73) DHODHKDM4EMEN1ALDH1A1KMT2A
SCHEMBL26074163 0.87 PLA2G2A (0.59) PLA2G2ADHODHKDM4EMEN1ALDH1A1
SCHEMBL26074129 0.85 PLA2G2A (0.74) PLA2G2ADHODHKDM4EMEN1ALDH1A1
SCHEMBL26074176 0.84 PLA2G2A (0.53) PLA2G2ADHODHKDM4EMEN1ALDH1A1
SCHEMBL26074208 0.84 PLA2G2A (0.56) PLA2G2ADHODHKDM4EMEN1ALDH1A1
SCHEMBL26074173 0.84 PLA2G2A (0.56) PLA2G2ADHODHKDM4EMEN1ALDH1A1
SCHEMBL26074194 0.83 PLA2G2A (0.55) PLA2G2ADHODHKDM4EMEN1ALDH1A1
SCHEMBL26074143 0.83 PLA2G2A (0.72) PLA2G2ADHODHKDM4EMEN1ALDH1A1
SCHEMBL28677971 0.83 PLA2G2A (0.73) PLA2G2ADHODHKDM4EMEN1ALDH1A1
SCHEMBL26074148 0.82 PLA2G2A (0.71) PLA2G2ADHODHKDM4EMEN1ALDH1A1

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 PLA2G2A 1679/4885DHODH 1/4885KDM4E 1396/4885

“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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