SCHEMBL6884496

SCHEMBL6884496

O=C(NS(=O)(=O)F)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.58
CA1 P00915 2/20 0.58
CA9 Q16790 2/20 0.58
HDAC3 O15379 1/20 0.58
IDO1 P14902 1/20 0.58
ALOX15 P16050 1/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC7 Q8WUI4 1/20 0.58
HDAC2 Q92769 1/20 0.58
HSD17B10 Q99714 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
NCOR2 Q9Y618 1/20 0.58
LMNA P02545 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
FLT1 P17948 1/20 0.53
FLT4 P35916 1/20 0.53
KDR P35968 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53

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
SCHEMBL5819670 0.84 CA12 (0.65) CA12CA1CA9HDAC3IDO1
SCHEMBL3729389 0.80 CA12 (0.60) CA12CA1CA9HDAC3IDO1
SCHEMBL712594 0.78 CA1 (0.58) CA12CA1CA9HDAC3IDO1
SCHEMBL28975516 0.78 CA12 (0.58) CA12CA1CA9HDAC3IDO1
SCHEMBL1750909 0.78 CA12 (0.58) CA12CA1CA9HDAC3IDO1
SCHEMBL5372882 0.78 HDAC3 (0.58) CA12CA1CA9HDAC3IDO1
SCHEMBL364110 0.78 HDAC3 (0.58) CA12CA1CA9HDAC3IDO1
SCHEMBL178335 0.78 HDAC3 (0.52) CA12CA1CA9HDAC3IDO1
Hydrochloric Acid SCHEMBL4438185 0.77 P4HTM (0.56) CA12CA1CA9HDAC3IDO1
SCHEMBL974471 0.77 KMT2A (0.56) CA12CA1CA9HDAC3IDO1

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-20040241706-A1 Highly specific modulators of GTPases for target validation IRM, LLC 2004-12-02 US disclosed
WO-2004024082-A2 HIGHLY SPECIFIC MODULATORS OF GTPASES FOR TARGET VALIDATION IRM, LLC (GB) 2004-03-25 WO 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-20040241706-A1 Highly specific modulators of GTPases for target validation CDC42, ARHGDIB, ARHGEF2 CA12 4877/4885CA1 4879/4885CA9 4875/4885

“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.