SCHEMBL25453428

SCHEMBL25453428

C/N=N/c1ccc(O)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.54
▸ PTGS2 P35354 1/20 0.54
▸ HSD17B10 Q99714 3/20 0.46
▸ TSHR P16473 2/20 0.46
▸ CA2 P00918 2/20 0.43
▸ CA1 P00915 1/20 0.43
▸ BRD4 O60885 1/20 0.40
▸ ESR2 Q92731 2/20 0.39
▸ KMT2A Q03164 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ BLVRB P30043 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38

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
SCHEMBL21125070 0.87 PTGS1 (0.67) PTGS1PTGS2HSD17B10TSHRCA2
SCHEMBL21125071 0.80 KMT2A (0.59) PTGS1PTGS2HSD17B10TSHRCA2
SCHEMBL10598869 0.78 PTGS1 (0.62) PTGS1PTGS2HSD17B10TSHRBRD4
SCHEMBL10598861 0.78 PTGS1 (0.62) PTGS1PTGS2HSD17B10TSHRBRD4
SCHEMBL15804264 0.77 KMT2A (0.59) HSD17B10BRD4ESR2KMT2AMEN1
SCHEMBL10788334 0.76 PTGS1 (0.55) PTGS1PTGS2HSD17B10TSHRCA2
SCHEMBL10823843 0.76 PTGS1 (0.55) PTGS1PTGS2HSD17B10TSHRCA2
SCHEMBL10823844 0.76 PTGS1 (0.55) PTGS1PTGS2HSD17B10TSHRCA2
SCHEMBL2448393 0.75 HSD17B10 (0.46) PTGS1PTGS2HSD17B10TSHRCA2
SCHEMBL11213671 0.74 PTGS1 (0.53) PTGS1PTGS2HSD17B10TSHRCA2

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-20230146909-A1 DYE INK COMPOSITION, BLACK DYE INK, INK JET RECORDING DYE INK, INK JET RECORDING METHOD, AND AQUEOUS DYE SOLUTION FUJIFILM CORPORATION (JP) 2023-05-11 — — 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-20230146909-A1 DYE INK COMPOSITION, BLACK DYE INK, INK JET RECORDING DYE INK, INK JET RECORDING METHOD, AND AQUEOUS DYE SOLUTION H1-4, H1-0, HCN4 PTGS1 2069/4885PTGS2 2443/4885HSD17B10 2098/4885

“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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