SCHEMBL19985755

SCHEMBL19985755

O=S(=O)(Cl)c1ccc(NCO)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA1 P00915 15/20 0.39
CA2 P00918 14/20 0.39
CA12 O43570 13/20 0.39
CA9 Q16790 12/20 0.39
PRMT1 Q99873 1/20 0.39
CA7 P43166 1/20 0.38
CA14 Q9ULX7 2/20 0.37
CA5A P35218 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
ACHE P22303 1/20 0.36

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
SCHEMBL3517591 0.81 TDP1 (0.51) ALDH1A1TDP1CA1CA2CA12
SCHEMBL21589347 0.81 LMNA (0.48) ALDH1A1TDP1CA1CA2CA12
SCHEMBL28201480 0.79 CA1 (0.61) CA1CA2CA12CA9CA7
SCHEMBL29182471 0.76 CA1 (0.45) ALDH1A1HSD17B10TDP1CA1CA2
SCHEMBL19618274 0.76 ALDH1A1 (0.48) ALDH1A1HSD17B10TDP1CA1CA2
SCHEMBL651902 0.74 ALDH1A1 (0.71) ALDH1A1HSD17B10TDP1CA1CA2
Sulfuric Acid SCHEMBL9450963 0.72 ALDH1A1 (0.57) ALDH1A1HSD17B10CA1CA2CA12
SCHEMBL12113370 0.72 KMT2A (0.54) CA1CA2CA12CA9PRMT1
SCHEMBL460563 0.71 ALDH1A1 (0.48) ALDH1A1HSD17B10TDP1CA1CA2
SCHEMBL20998325 0.71 ALDH1A1 (0.48) ALDH1A1HSD17B10TDP1CA1CA2

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-20180079833-A1 BONDING TISSUES AND CROSS-LINKING PROTEINS WITH NAPHTHALIMIDE COMPOUNDS ALUMEND, LLC (US) 2018-03-22 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-20180079833-A1 BONDING TISSUES AND CROSS-LINKING PROTEINS WITH NAPHTHALIMIDE COMPOUNDS SUN2, BMP2, TAGLN2 ALDH1A1 1539/4885HSD17B10 2647/4885TDP1 2540/4885

“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.