SCHEMBL26540975

SCHEMBL26540975

CC(C)(C)CCc1cc(F)ccc1C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 1/20 0.36
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
SLC6A4 P31645 2/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 1/20 0.33
KCNH2 Q12809 3/20 0.33
TMEM97 Q5BJF2 3/20 0.33
SIGMAR1 Q99720 3/20 0.33
RIPK1 Q13546 1/20 0.33
IDO1 P14902 2/20 0.32
NR3C1 P04150 1/20 0.32
NR3C2 P08235 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30

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
SCHEMBL18176645 0.83 F2RL1 (0.38) PTGS1PTGS2KCNH2RIPK1IDO1
SCHEMBL14850384 0.79 ALOX5 (0.41) PTGS2
SCHEMBL13437624 0.79 RIPK1 (0.41) PTGS1PTGS2SLC6A4SLC6A2HTR2A
SCHEMBL21718976 0.79 PTGS1 (0.37) PTGS1PTGS2SLC6A4SLC6A2HTR2A
SCHEMBL14850102 0.77 MPO (0.48) SLC6A4SLC6A2HTR2A
SCHEMBL20206822 0.77 HTR2A (0.41) SLC6A4SLC6A2HTR2AHTR2C
SCHEMBL6742833 0.77 IDO1 (0.46) PARK7HTR2AHTR2CKCNH2RIPK1
SCHEMBL13547861 0.77 PTGS1 (0.40) PTGS1PTGS2SLC6A4SLC6A2RIPK1
SCHEMBL12459222 0.77 MPO (0.41) PTGS1PTGS2SLC6A4SLC6A2HTR2A
SCHEMBL23682593 0.75 KCNH2 (0.40) SLC6A4SLC6A2HTR2AKCNH2TMEM97

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-11787799-B2 Potent antiviral pyrazolopyridine compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-17 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 (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-11787799-B2 Potent antiviral pyrazolopyridine compounds MAVS, VRK1, VRK2 PARK7 816/4885PTGS1 2383/4885PTGS2 2761/4885

“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.