SCHEMBL23758136

SCHEMBL23758136

Cc1cc(F)ncc1NS(=O)(=O)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 12/20 0.36
JAK2 O60674 3/20 0.35
JAK1 P23458 4/20 0.34
JAK3 P52333 2/20 0.34
BRDT Q58F21 2/20 0.34
PTGS1 P23219 6/20 0.34
PTGS2 P35354 6/20 0.34
HDAC1 Q13547 2/20 0.34
BRD2 P25440 1/20 0.32
BRD3 Q15059 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
SCHEMBL16492684 0.81 KEAP1 (0.41) PTGS1PTGS2
SCHEMBL19303545 0.79 BRD4 (0.46) BRD4JAK2JAK1JAK3PTGS1
SCHEMBL20290539 0.78 NNMT (0.42) JAK2JAK3PTGS1PTGS2
SCHEMBL24435816 0.73 BRD4 (0.45) BRD4
SCHEMBL24304320 0.73 BRD4 (0.57) BRD4JAK2JAK1JAK3BRDT
SCHEMBL25215031 0.70 NOS3 (0.31)
SCHEMBL17336598 0.69 RAB9A (0.42)
SCHEMBL17336530 0.68 AAK1 (0.42) BRD4
SCHEMBL18348353 0.67 MAPK14 (0.35)
SCHEMBL24435768 0.67 PTGS1 (0.49) PTGS1PTGS2

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-20220017507-A1 PI-Kinase Inhibitors with Anti-Infective Activity THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-01-20 US disclosed
US-11091472-B2 PI-kinase inhibitors with anti-infective activity THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-08-17 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 (2 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-11091472-B2 PI-kinase inhibitors with anti-infective activity PIP4K2A, PIP5K1A, PIP4K2C BRD4 265/4885JAK2 729/4885JAK1 180/4885
US-20220017507-A1 PI-Kinase Inhibitors with Anti-Infective Activity PIP4K2A, PIP5K1A, PIP4K2C BRD4 276/4885JAK2 833/4885JAK1 246/4885

“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.