SCHEMBL26075893

SCHEMBL26075893

Cc1cc(-c2ccc(-c3ccc(N(C)C)cc3)c(F)c2)nc2ccc(P)cc12

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.37
▸ ESR2 Q92731 5/20 0.37
▸ PSMB5 P28074 2/20 0.36
▸ APP P05067 6/20 0.34
▸ TCF4 P15884 1/20 0.34
▸ CTNNB1 P35222 1/20 0.34
▸ SYK P43405 2/20 0.34
▸ TOP1 P11387 1/20 0.33
▸ ADK P55263 1/20 0.33
▸ KDM1A O60341 1/20 0.33

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
SCHEMBL26075314 0.88 APP (0.43) ESR1ESR2PSMB5APPTCF4
SCHEMBL26075896 0.86 ESR1 (0.35) ESR1ESR2TOP1
SCHEMBL26075419 0.84 KDM1A (0.46) ESR1ESR2APPTOP1KDM1A
SCHEMBL26075894 0.84 ESR1 (0.37) ESR1ESR2APPTOP1
SCHEMBL26075865 0.84 ACACA (0.46) APP
SCHEMBL26075891 0.82 DHODH (0.44) ESR1ESR2TOP1
SCHEMBL26075870 0.81 MAPT (0.38) ESR1ESR2APP
SCHEMBL26075889 0.81 ESR1 (0.38) ESR1ESR2TOP1
SCHEMBL26075885 0.81 HMOX1 (0.41) ESR1ESR2CTNNB1
SCHEMBL26075879 0.81 ESR1 (0.35) ESR1ESR2APPTOP1

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 4530/4885PSMB5 3752/4885

“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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