SCHEMBL29296706

SCHEMBL29296706

CCCS(=O)(=O)c1cc(C#N)ccn1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.41
JAK1 P23458 2/20 0.41
TYK2 P29597 2/20 0.41
PTGDR2 Q9Y5Y4 2/20 0.38
TRPV4 Q9HBA0 1/20 0.38
RORC P51449 2/20 0.35
HRH4 Q9H3N8 1/20 0.34
KCNH2 Q12809 2/20 0.33
NPY5R Q15761 2/20 0.33
CLK4 Q9HAZ1 1/20 0.33
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
GRM5 P41594 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL20084360 0.89 JAK2 (0.43) JAK2JAK1TYK2TRPV4RORC
SCHEMBL29296543 0.84 JAK2 (0.39) JAK2JAK1TYK2TRPV4RORC
SCHEMBL23388245 0.79 JAK2 (0.39) JAK2JAK1TYK2RORCHCRTR1
SCHEMBL568039 0.78 JAK2 (0.38) JAK2JAK1TYK2TRPV4CLK4
SCHEMBL7213518 0.75 CA1 (0.42) JAK2JAK1TYK2CLK4
SCHEMBL15970403 0.75 TRPV4 (0.43) JAK2JAK1TYK2TRPV4CLK4
SCHEMBL22954458 0.74 JAK2 (0.43) JAK2JAK1TYK2TRPV4CLK4
SCHEMBL5078527 0.73 RAD51 (0.46) JAK2JAK1TYK2TRPV4CLK4
SCHEMBL5078530 0.73 KDM4C (0.36) JAK2JAK1TYK2TRPV4CLK4
Hydrochloric Acid SCHEMBL28146131 0.73 KDM4C (0.36) JAK2JAK1TYK2TRPV4CLK4

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-20240228495-A1 Tricyclic Inhibitors of Influenza Virus Endonuclease STANFORD RES INST INT (US) 2024-07-11 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-20240228495-A1 Tricyclic Inhibitors of Influenza Virus Endonuclease RNASEH1, RNASEL, DNASE1 JAK2 3919/4885JAK1 3191/4885TYK2 4599/4885

“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.