SCHEMBL32690699

SCHEMBL32690699

O=c1c(O)c(-c2ccccc2F)[nH]c2ccc([N+](=O)[O-])cc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSV O60911 3/20 0.59
▸ CTSL P07711 3/20 0.59
▸ PARP1 P09874 1/20 0.52
▸ FASN P49327 1/20 0.51
▸ CDK5 Q00535 4/20 0.49
▸ CDK5R1 Q15078 4/20 0.49
▸ CCNE1 P24864 4/20 0.49
▸ CDK2 P24941 4/20 0.49
▸ GSK3B P49841 3/20 0.49
▸ GSK3A P49840 2/20 0.49
▸ CDK9 P50750 2/20 0.49
▸ CCNB2 O95067 2/20 0.49
▸ CDK1 P06493 2/20 0.49
▸ CCNB1 P14635 2/20 0.49
▸ CCNB3 Q8WWL7 2/20 0.49
▸ CDC7 O00311 1/20 0.49
▸ PLK4 O00444 1/20 0.49
▸ IKBKB O14920 1/20 0.49
▸ PDPK1 O15530 1/20 0.49
▸ ROCK2 O75116 1/20 0.49

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
SCHEMBL32690728 0.86 CTSV (0.59) CTSVCTSLPARP1FASNCDK5
SCHEMBL32690742 0.85 CTSV (0.55) CTSVCTSLPARP1FASNCDK5
SCHEMBL32690794 0.80 NMUR2 (0.50) CDK5CDK5R1CCNE1CDK2GSK3B
SCHEMBL32690670 0.80 PARP1 (0.48) PARP1CDK5CDK5R1GSK3BCCNB2
SCHEMBL15331823 0.80 CTSV (0.50) CTSVCTSLPARP1FASNCDK5
SCHEMBL32690752 0.76 CTSV (0.46) CTSVCTSLPARP1FASNCDK5
SCHEMBL21828651 0.75 CTSV (1.00) CTSVCTSLPARP1FASNCDK5
SCHEMBL29519210 0.75 CTSV (1.00) CTSVCTSLPARP1FASNCDK5
SCHEMBL11731608 0.74 PARP1 (0.55) CTSVCTSLPARP1FASNCDK5
SCHEMBL23791621 0.73 TUBB4A (0.54) CTSVCTSLKMT2AMEN1ALDH1A1

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 CTSV 2941/4885CTSL 2953/4885PARP1 113/4885

“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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