SCHEMBL26048255

SCHEMBL26048255

O=S1(=O)NC(F)(F)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
NOX1 Q9Y5S8 1/20 0.39
CA12 O43570 8/20 0.38
CA1 P00915 8/20 0.38
CA2 P00918 8/20 0.38
CA9 Q16790 8/20 0.38
CA4 P22748 7/20 0.38
CA7 P43166 7/20 0.38
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
BCHE P06276 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
GPR3 P46089 1/20 0.33
PLCG1 P19174 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL448460 0.75 KMT2A (0.39) KMT2AMEN1NOX1CA12CA1
SCHEMBL5523699 0.75 KMT2A (0.39) KMT2AMEN1NOX1CA12CA1
SCHEMBL17169742 0.75 KMT2A (0.39) KMT2AMEN1NOX1CA12CA1
Ammonia Solution, Strong SCHEMBL446104 0.73 KMT2A (0.38) KMT2AMEN1NOX1CA12CA1
SCHEMBL11240630 0.72 CYP2C9 (0.37) KMT2AMEN1NOX1CA12CA1
SCHEMBL7685977 0.71 KMT2A (0.35) KMT2AMEN1NOX1CA12CA1
SCHEMBL28234767 0.69 KMT2A (0.34) KMT2AMEN1NOX1CA12CA1
SCHEMBL28241763 0.69 KMT2A (0.34) KMT2AMEN1NOX1CA12CA1
SCHEMBL11248429 0.67 MEN1 (0.50) KMT2AMEN1NOX1CA12CA1
SCHEMBL349613 0.66 BACE1 (0.40) KMT2AMEN1NOX1CA12CA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242495-A1 Nitrosation Reagents and Methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-08-03 US disclosed
US-20230242495-A1 Nitrosation Reagents and Methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-08-03 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-20230242495-A1 Nitrosation Reagents and Methods NOS2, NOS1, NNMT KMT2A 3043/4885MEN1 1149/4885NOX1 7/4885

“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.