SCHEMBL26075426

SCHEMBL26075426

CNc1ccc(-c2ccc(-c3cc(C=O)c4cc(C)ccc4n3)cc2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.45
▸ LMNA P02545 5/20 0.45
▸ KDM4E B2RXH2 5/20 0.45
▸ MAPT P10636 4/20 0.45
▸ HPGD P15428 3/20 0.45
▸ HSP90AA1 P07900 3/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.45
▸ THRB P10828 3/20 0.43
▸ GAA P10253 1/20 0.42
▸ APP P05067 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ SNCA P37840 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ ESR1 P03372 4/20 0.38
▸ ESR2 Q92731 4/20 0.38
▸ HSD17B10 Q99714 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL26075435 0.89 ALDH1A1 (0.46) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL26075421 0.85 ALDH1A1 (0.40) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL26075337 0.85 MAPT (0.49) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL26075408 0.83 DHODH (0.45) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL26075401 0.82 DHODH (0.44) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL26075369 0.82 KDM4E (0.40) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL26075381 0.82 MAPT (0.38) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL26075428 0.81 ALDH1A1 (0.49) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL26075318 0.80 APP (0.43) APPKMT2AMEN1ESR1ESR2
SCHEMBL26075569 0.78 DHODH (0.48) ALDH1A1GAAAPPKMT2AMEN1

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 ALDH1A1 88/4885LMNA 1972/4885KDM4E 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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