SCHEMBL24974546

SCHEMBL24974546

COc1ccc(OC)c(N2CC(C(=O)Nc3ccc(CC4N=NC(C(C)(C)OC(C)CNC(=O)CCCC[C@@H]5SC[C@@H]6NC(=O)N[C@@H]65)=N4)cc3)CC2=O)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ITGB1 P05556 2/20 0.39
▸ ITGA4 P13612 2/20 0.39
▸ KEAP1 Q14145 1/20 0.38
▸ PKM P14618 2/20 0.38
▸ HTR6 P50406 1/20 0.37
▸ WDR5 P61964 1/20 0.36
▸ SLC6A3 Q01959 3/20 0.36
▸ CA12 O43570 4/20 0.36
▸ CA1 P00915 4/20 0.36
▸ CA2 P00918 4/20 0.36
▸ CA9 Q16790 4/20 0.36
▸ CDK8 P49336 1/20 0.36
▸ HSPA8 P11142 2/20 0.36
▸ PTPRF P10586 1/20 0.36
▸ PTPN2 P17706 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ HSP90AB1 P08238 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
SCHEMBL24974545 0.85 PKM (0.46) ITGB1ITGA4KEAP1PKMHTR6
SCHEMBL24974368 0.75 PKM (0.47) ITGB1ITGA4KEAP1PKMHTR6
SCHEMBL24974776 0.74 PKM (0.49) KEAP1PKMHTR6WDR5HSPA8
SCHEMBL24974540 0.71 PKM (0.47) PKMHTR6HSPA8PTPN2PTPN1
SCHEMBL24974633 0.69 PKM (0.47) KEAP1PKMHTR6
SCHEMBL24974743 0.67 OPRM1 (0.48) KEAP1PKMCA12CA1CA2
SCHEMBL23625180 0.63 CA12 (0.60) KEAP1PKMSLC6A3CA12CA1
SCHEMBL26073697 0.63 CA12 (0.64) ITGB1ITGA4KEAP1PKMCA12
SCHEMBL20280336 0.62 TDP1 (0.65) PKMCA12CA1CA2CA9
SCHEMBL19960776 0.62 TDP1 (0.65) PKMCA12CA1CA2CA9

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-11572370-B2 CD16A binding agents and uses thereof BIOHAVEN THERAPEUTICS LTD. (US) 2023-02-07 — — 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-11572370-B2 CD16A binding agents and uses thereof FCGR1A, FCGR2A, FCGR3B ITGB1 98/4885ITGA4 85/4885KEAP1 3726/4885

“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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