SCHEMBL26075136

SCHEMBL26075136

Cc1cc(-c2ccc(-c3ccccc3)c(F)c2)nc2ccc(F)cc12

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.50
▸ ESR2 Q92731 1/20 0.50
▸ DHODH Q02127 15/20 0.49
▸ DHFR P00374 1/20 0.47
▸ ALKBH5 Q6P6C2 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TOP1 P11387 3/20 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
SCHEMBL26075308 0.92 DHODH (0.55) ESR1ESR2DHODHDHFRALKBH5
SCHEMBL26075137 0.91 DHODH (0.51) ESR1ESR2DHODHDHFRALKBH5
SCHEMBL26075230 0.88 PLA2G2A (0.54) DHODHMEN1KMT2A
SCHEMBL26075318 0.88 APP (0.43) ESR1ESR2DHODHDHFRALKBH5
SCHEMBL26075314 0.88 APP (0.43) ESR1ESR2DHODHDHFRALKBH5
SCHEMBL14700162 0.86 DHODH (0.58) DHODHMEN1KMT2ATOP1
SCHEMBL26075302 0.85 DHODH (0.42) ESR1ESR2DHODHDHFRALKBH5
SCHEMBL26075255 0.85 PLA2G2A (0.41) ESR1ESR2DHODHDHFRALKBH5
SCHEMBL26075138 0.85 DHODH (0.41) ESR1ESR2DHODHDHFRALKBH5
SCHEMBL26075282 0.85 DHODH (0.43) ESR1ESR2DHODHDHFRALKBH5

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 ESR1 4427/4885ESR2 4530/4885DHODH 1/4885

“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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