SCHEMBL29617670

SCHEMBL29617670

Cc1c(-c2ccc(-c3ccc(F)cc3)cc2)nc2c(F)cccc2c1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 18/20 0.65
DHFR P00374 1/20 0.58
ALKBH5 Q6P6C2 1/20 0.58
PDE10A Q9Y233 2/20 0.53
TSHR P16473 1/20 0.53
TP53 P04637 1/20 0.52

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
SCHEMBL23590311 1.00 DHODH (0.65) DHODHDHFRALKBH5PDE10ATSHR
SCHEMBL4228780 0.91 DHODH (0.70) DHODHDHFRALKBH5PDE10ATSHR
SCHEMBL29617658 0.88 DHODH (0.66) DHODHDHFRALKBH5PDE10A
SCHEMBL23590313 0.88 DHODH (0.66) DHODHDHFRALKBH5PDE10A
SCHEMBL29617666 0.77 DHODH (0.90) DHODHDHFRALKBH5PDE10A
SCHEMBL23590030 0.77 DHODH (0.90) DHODHDHFRALKBH5PDE10A
SCHEMBL28170815 0.77 DHODH (0.73) DHODHPDE10ATSHR
SCHEMBL8732559 0.75 DHODH (1.00) DHODHDHFRALKBH5
SCHEMBL4229394 0.75 TACR3 (0.52) DHODHPDE10ATSHRTP53
SCHEMBL28170272 0.74 DHODH (0.65) DHODHPDE10ATSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240294477-A1 METHODS AND COMPOSITIONS FOR INHIBITION OF DIHYDROOROTATE DEHYDROGENASE OHIO STATE INNOVATION FOUNDATION (US) 2024-09-05 US disclosed
US-11999697-B2 Methods and compositions for inhibition of dihydroorotate dehydrogenase OHIO STATE INNOVATION FOUNDATION (US) 2024-06-04 US disclosed
US-11312686-B2 Methods and compositions for inhibition of dihydroorotate dehydrogenase OHIO STATE INNOVATION FOUNDATION (US) 2022-04-26 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 (3 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-11312686-B2 Methods and compositions for inhibition of dihydroorotate dehydrogenase DHODH, DLD, DPYD DHODH 1/4885DHFR 5/4885ALKBH5 668/4885
US-20240294477-A1 METHODS AND COMPOSITIONS FOR INHIBITION OF DIHYDROOROTATE DEHYDROGENASE DHODH, DLD, DPYD DHODH 1/4885DHFR 5/4885ALKBH5 672/4885
US-11999697-B2 Methods and compositions for inhibition of dihydroorotate dehydrogenase DHODH, DLD, DPYD DHODH 1/4885DHFR 5/4885ALKBH5 672/4885

“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.