SCHEMBL30771732

SCHEMBL30771732

O=C(Nc1c(F)cccc1F)c1cc(Cl)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 12/20 0.64
▸ P2RX4 Q99571 6/20 0.64
▸ P2RX7 Q99572 6/20 0.64
▸ TAS1R3 Q7RTX0 1/20 0.62
▸ TAS1R1 Q7RTX1 1/20 0.62
▸ TAS1R2 Q8TE23 1/20 0.62
▸ TMPRSS4 Q9NRS4 7/20 0.61
▸ KCNMA1 Q12791 4/20 0.60
▸ SLC2A1 P11166 1/20 0.58
▸ MEN1 O00255 1/20 0.55
▸ IKBKB O14920 1/20 0.55
▸ CHUK O15111 1/20 0.55
▸ KDR P35968 1/20 0.55
▸ FLT3 P36888 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ MYLK Q15746 1/20 0.55
▸ MAP4K5 Q9Y4K4 1/20 0.55

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
SCHEMBL18341307 1.00 P2RX1 (0.64) P2RX1P2RX4P2RX7TAS1R3TAS1R1
SCHEMBL24460159 0.87 P2RX1 (0.53) P2RX1P2RX4P2RX7TAS1R3TAS1R1
SCHEMBL18341338 0.84 P2RX1 (0.68) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL330391 0.84 P2RX1 (0.66) P2RX1P2RX4P2RX7TAS1R3TAS1R1
SCHEMBL30771722 0.84 P2RX1 (0.68) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL25349217 0.82 PDE4D (0.47) P2RX1P2RX4P2RX7TAS1R3TAS1R1
SCHEMBL24460167 0.82 P2RX1 (0.71) P2RX1P2RX4P2RX7TAS1R3TAS1R1
SCHEMBL31238369 0.80 TAS1R3 (0.86) P2RX1P2RX4P2RX7TAS1R3TAS1R1
SCHEMBL14886089 0.79 P2RX1 (0.59) P2RX1P2RX4P2RX7TAS1R3TAS1R1
SCHEMBL11932156 0.79 P2RX1 (0.78) P2RX1P2RX4P2RX7TAS1R3TAS1R1

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-20240002332-A1 Small Molecule Inhibitors of SARS-CoV-2 Infections THE FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION 2024-01-04 — — 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-20240002332-A1 Small Molecule Inhibitors of SARS-CoV-2 Infections ACE2, ACE, TMPRSS2 P2RX1 2669/4885P2RX4 3287/4885P2RX7 2285/4885

“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.

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