SCHEMBL20913005

SCHEMBL20913005

Nc1nc(N)nc(N)n1.O=P(O)(CO)CO

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.39
CASP1 P29466 1/20 0.35
LMNA P02545 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
SCHEMBL11665998 0.83 CYP1A2 (0.40) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL28199623 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL73239 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL669448 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL10873614 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL4801853 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL752823 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL670321 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL407305 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA
Phosphoric Acid SCHEMBL300964 0.80 CYP1A2 (0.42) CYP1A2CASP1LMNA

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-20190119193-A1 COMPOSITION FOR REGULATING PLANT GROWTH, METHOD FOR TREATING PLANTS THEREWITH, AND ACTIVE INGREDIENT THEREOF Ivan Aleksandrovich Starikov 2019-04-25 US disclosed
EP-3473098-A1 COMPOSITION FOR REGULATING PLANT GROWTH, METHOD FOR TREATING PLANTS THEREWITH, AND ACTIVE INGREDIENT THEREOF Gorbunov, Sergei Valeryevich (RU) 2019-04-24 EP 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-20190119193-A1 COMPOSITION FOR REGULATING PLANT GROWTH, METHOD FOR TREATING PLANTS THEREWITH, AND ACTIVE INGREDIENT THEREOF OGDH, GOT1, OAT CYP1A2 857/4885CASP1 3980/4885LMNA 3832/4885

“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.