SCHEMBL26074491

SCHEMBL26074491

CC(C)Oc1ccc(-c2ccc(-c3cc(C(=O)O)c4cc(I)ccc4n3)nc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 3/20 0.45
▸ DHODH Q02127 7/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ EIF4A1 P60842 1/20 0.43
▸ HSD17B10 Q99714 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ HIF1A Q16665 2/20 0.42
▸ PTGES O14684 1/20 0.42
▸ ALOX5 P09917 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41

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
SCHEMBL26074473 0.89 KDM4E (0.56) DHODHKDM4EEIF4A1HSD17B10SMN1; SMN2
SCHEMBL26074019 0.89 MCL1 (0.56) MCL1DHODHKDM4EHSD17B10SMN1; SMN2
SCHEMBL23590214 0.89 DHODH (0.58) MCL1DHODHKDM4EEIF4A1HSD17B10
SCHEMBL26074493 0.88 DHODH (0.48) DHODHKDM4EEIF4A1HSD17B10SMN1; SMN2
SCHEMBL26074463 0.87 KDM4E (0.58) DHODHKDM4EEIF4A1HSD17B10SMN1; SMN2
SCHEMBL26074531 0.86 DHODH (0.49) DHODHKDM4EEIF4A1HSD17B10SMN1; SMN2
SCHEMBL26074524 0.86 DHODH (0.48) DHODHKDM4EEIF4A1HSD17B10SMN1; SMN2
SCHEMBL23590055 0.85 DHODH (0.50) MCL1DHODHKDM4EHSD17B10SMN1; SMN2
SCHEMBL26074608 0.84 DHODH (0.51) MCL1DHODHKDM4EEIF4A1HSD17B10
SCHEMBL26074580 0.82 EIF4A1 (0.46) DHODHKDM4EEIF4A1HSD17B10MEN1

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 MCL1 94/4885DHODH 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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