SCHEMBL32690736

SCHEMBL32690736

COC(=O)c1ccc(CNc2ccc3c(=O)c(O)c(-c4ccccc4C(F)(F)F)[nH]c3c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 5/20 0.48
▸ CA1 P00915 3/20 0.44
▸ CA2 P00918 3/20 0.44
▸ ALOX5 P09917 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ CYP19A1 P11511 1/20 0.41
▸ PARP1 P09874 1/20 0.39
▸ KIF11 P52732 1/20 0.39
▸ GABRP O00591 1/20 0.39
▸ GABRD O14764 1/20 0.39
▸ GABRA1 P14867 1/20 0.39
▸ GABRB1 P18505 1/20 0.39
▸ GABRG2 P18507 1/20 0.39
▸ GABRB3 P28472 1/20 0.39
▸ GABRA5 P31644 1/20 0.39
▸ GABRA3 P34903 1/20 0.39
▸ GABRA2 P47869 1/20 0.39

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
SCHEMBL32690681 0.93 GABRA1 (0.44) ARCA1CA2ALOX5CYP19A1
SCHEMBL32690823 0.89 AR (0.49) ARKDM4ENPC1HTTRAB9A
SCHEMBL32690851 0.88 NPC1 (0.46) KDM4ENPC1HTTRAB9APARP1
SCHEMBL32690805 0.86 AR (0.45) ARALOX5KDM4ENPC1HTT
SCHEMBL32690723 0.84 POLB (0.44) KDM4EHTTPARP1KIF11
SCHEMBL32690780 0.83 USP1 (0.42) CA1CA2HTTUSP1WDR48
SCHEMBL32690668 0.82 AR (0.46) AR
SCHEMBL32690725 0.82 HDAC1 (0.44) ARKDM4ENPC1HTTRAB9A
SCHEMBL32690734 0.81 NPC1 (0.46) KDM4ENPC1HTTRAB9A
SCHEMBL32690748 0.79 CCNB2 (0.43) ARALOX5GABRPGABRDGABRA1

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-20260085046-A1 Dual Function Compounds For NADPH Oxidase Inhibition And Histone Deacetylase Inhibition TAIWANJ PHARMACEUTICALS CO LTD (TW) 2026-03-26 — — 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-20260085046-A1 Dual Function Compounds For NADPH Oxidase Inhibition And Histone Deacetylase Inhibition NOX1, NOX4, CYBB AR 532/4885CA1 1313/4885CA2 450/4885

“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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