SCHEMBL13614439

SCHEMBL13614439

CCCOP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=C3C=C(c4ccccc4[N+](=O)[O-])OC3NC2=O)C[C@H]1OC(=O)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.36
POLB P06746 1/20 0.32
P2RY6 Q15077 1/20 0.32
P2RY14 Q15391 1/20 0.32
TYMS P04818 2/20 0.32
POLA1 P09884 1/20 0.31
P2RX3 P56373 1/20 0.31
P2RX4 Q99571 1/20 0.31
P2RX2 Q9UBL9 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
GLA P06280 1/20 0.30
RAB9A P51151 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL14017199 1.00 RNASE1 (0.36) RNASE1POLBP2RY6P2RY14TYMS
SCHEMBL13614480 0.90 RNASE1 (0.35) RNASE1POLBTYMS
SCHEMBL13614865 0.90 RNASE1 (0.35) RNASE1POLBTYMS
SCHEMBL14017374 0.64 RNASE1 (0.35) RNASE1POLBP2RY6POLA1P2RX3
SCHEMBL14400570 0.64 RNASE1 (0.35) RNASE1POLBP2RY6POLA1P2RX3
SCHEMBL13614877 0.63 P2RY2 (0.44) P2RY6P2RY14
SCHEMBL14017161 0.62 P2RY6 (0.40) P2RY6P2RY14
SCHEMBL14017178 0.61 P2RY2 (0.60) P2RY6P2RY14
SCHEMBL13614431 0.61 P2RY2 (0.60) P2RY6P2RY14
SCHEMBL15694805 0.60 POLB (0.58) RNASE1POLBTYMSPOLA1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612047-B2 Degradation-resistant mononucleoside phosphate compounds INSPIRE PHARMACEUTICALS, INC. (US) 2009-11-03 US disclosed
US-7612047-B2 Degradation-resistant mononucleoside phosphate compounds INSPIRE PHARMACEUTICALS, INC. (US) 2009-11-03 US disclosed
US-20090076256-A1 DEGRADATION-RESISTANT MONONUCLEOSIDE PHOSPHATE COMPOUNDS DOUGLASS III JAMES G 2009-03-19 US disclosed
US-20090076256-A1 DEGRADATION-RESISTANT MONONUCLEOSIDE PHOSPHATE COMPOUNDS DOUGLASS III JAMES G 2009-03-19 US disclosed
US-7435724-B2 Degradation-resistant mononucleoside phosphate compounds INSPIRE PHARMACEUTICAL, INC. (US) 2008-10-14 US disclosed
US-20070244068-A1 Degradation-resistant mononucleoside phosphate compounds INSPIRE PHARMACEUTICALS, INC. 2007-10-18 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-20070244068-A1 Degradation-resistant mononucleoside phosphate compounds PNKP, ENTPD5, ENPP1 RNASE1 147/4885POLB 160/4885P2RY6 39/4885
US-20090076256-A1 DEGRADATION-RESISTANT MONONUCLEOSIDE PHOSPHATE COMPOUNDS PNKP, ENTPD5, ENPP1 RNASE1 147/4885POLB 160/4885P2RY6 39/4885

“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.