SCHEMBL26075310

SCHEMBL26075310

COCc1ccccc1-c1ccc(-c2cc(C)c3cc(F)ccc3n2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 12/20 0.42
▸ S1PR1 P21453 2/20 0.41
▸ S1PR3 Q99500 1/20 0.41
▸ ESR1 P03372 2/20 0.39
▸ ESR2 Q92731 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ DHFR P00374 1/20 0.38
▸ ALKBH5 Q6P6C2 1/20 0.38
▸ KCNN4 O15554 1/20 0.37
▸ PLA2G2A P14555 1/20 0.37
▸ PDE10A Q9Y233 1/20 0.37

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
SCHEMBL26075892 0.90 S1PR1 (0.41) DHODHS1PR1S1PR3ESR1ESR2
SCHEMBL26074087 0.89 DHODH (0.47) DHODHDHFRALKBH5PLA2G2APDE10A
SCHEMBL26075395 0.88 ACP1 (0.39) DHODHS1PR1S1PR3ESR1ESR2
SCHEMBL23590274 0.86 DHODH (0.58) DHODHS1PR1S1PR3ESR1ESR2
SCHEMBL26075137 0.85 DHODH (0.51) DHODHESR1ESR2MEN1KMT2A
SCHEMBL26075302 0.84 DHODH (0.42) DHODHESR1ESR2MEN1KMT2A
SCHEMBL26075305 0.82 DHODH (0.41) DHODHESR1ESR2MEN1KMT2A
SCHEMBL26075271 0.82 PDE10A (0.52) PDE10A
SCHEMBL26075396 0.82 DHODH (0.44) DHODHS1PR1S1PR3ESR1ESR2
SCHEMBL26075136 0.82 ESR1 (0.50) DHODHESR1ESR2MEN1KMT2A

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 1/4885S1PR1 1996/4885S1PR3 2218/4885

“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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