SCHEMBL26075438

SCHEMBL26075438

CCNc1ccccc1-c1ccc(-c2cc(C)c3cc(C(F)(F)F)ccc3n2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACP1 P24666 3/20 0.39
▸ ESR1 P03372 2/20 0.37
▸ ESR2 Q92731 2/20 0.37
▸ ALOX5AP P20292 6/20 0.37
▸ FEN1 P39748 6/20 0.37
▸ DHODH Q02127 1/20 0.37
▸ PTGFR P43088 1/20 0.36
▸ PDE10A Q9Y233 2/20 0.36
▸ PDE2A O00408 1/20 0.36
▸ MCHR1 Q99705 1/20 0.35
▸ CCNC P24863 1/20 0.35
▸ CDK8 P49336 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35
▸ TOP1 P11387 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
SCHEMBL26075333 0.88 DHODH (0.41) ACP1ESR1ESR2ALOX5APFEN1
SCHEMBL23590259 0.87 DHODH (0.46) ESR1ESR2ALOX5APFEN1DHODH
SCHEMBL26075432 0.86 FEN1 (0.42) ACP1ALOX5APFEN1MCHR1
SCHEMBL26075427 0.84 LMNA (0.39) ACP1ALOX5APFEN1DHODHMCHR1
SCHEMBL26075393 0.83 PDE10A (0.43) ALOX5APFEN1PDE10A
SCHEMBL26075395 0.81 ACP1 (0.39) ACP1ESR1ESR2ALOX5APFEN1
SCHEMBL26075411 0.79 HMOX1 (0.42) ACP1ALOX5APFEN1PDE2AMCHR1
SCHEMBL26075441 0.79 ALDH1A1 (0.42) ESR1ESR2ALOX5APFEN1DHODH
SCHEMBL26075424 0.79 KIF11 (0.43) ACP1ESR1ESR2ALOX5APFEN1
SCHEMBL26075920 0.78 ACP1 (0.44) ACP1ESR1ESR2ALOX5APFEN1

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 ACP1 2245/4885ESR1 4427/4885ESR2 4530/4885

“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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