SCHEMBL7074770

SCHEMBL7074770

COCCO[C@@H]1[C@H](OP(=O)(O)CC[Si](C)(c2ccccc2)c2ccccc2)[C@@H](C(OC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)C(=O)c2ccccc2)O[C@H]1n1cnc2c(N)ncnc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 2/20 0.41
P2RX4 Q99571 2/20 0.41
P2RX2 Q9UBL9 2/20 0.41
CARM1 Q86X55 2/20 0.38
ENPP1 P22413 1/20 0.38
P2RX6 O15547 1/20 0.38
P2RX1 P51575 1/20 0.38
P2RX5 Q93086 1/20 0.38
P2RY11 Q96G91 1/20 0.38
P2RX7 Q99572 1/20 0.38
TRDMT1 O14717 1/20 0.37
ADORA1 P30542 3/20 0.37
TYMP P19971 1/20 0.36
IMPDH2 P12268 2/20 0.36
IMPDH1 P20839 1/20 0.36

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
SCHEMBL7266107 0.86 ADORA1 (0.47) CARM1ENPP1TRDMT1ADORA1TYMP
SCHEMBL6835045 0.86 ADORA1 (0.45) P2RX3P2RX4P2RX2CARM1ENPP1
SCHEMBL6238364 0.86 P2RX3 (0.37) P2RX3P2RX4P2RX2CARM1ENPP1
SCHEMBL6229383 0.86 POLB (0.38) P2RX3P2RX4P2RX2CARM1ENPP1
SCHEMBL7074034 0.84 ST6GAL1 (0.38)
SCHEMBL6834851 0.82 P2RX3 (0.38) P2RX3P2RX4P2RX2CARM1ENPP1
SCHEMBL6231869 0.82 TAAR1 (0.41) TYMP
SCHEMBL10690523 0.80 ADORA3 (0.50) P2RX3P2RX4P2RX2CARM1TRDMT1
SCHEMBL6834950 0.79 P2RX3 (0.37) P2RX3P2RX4P2RX2CARM1ENPP1
SCHEMBL6835157 0.79 P2RX3 (0.37) P2RX3P2RX4P2RX2CARM1ENPP1

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-20030013864-A1 Method for the synthesis of nucleotide of oligonucleotide phosphoramidites GRIFFEY RICHARD H (US) 2003-01-16 US disclosed
US-6458941-B1 RECOVERED FROM WASTE PRODUCTS OF OLIGONUCLEOTIDE BIOSYNTHESIS ISIS PHARMACEUTICALS, INC. 2002-10-01 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-20030013864-A1 Method for the synthesis of nucleotide of oligonucleotide phosphoramidites NUDT1, MTAP, PHOSPHO1 P2RX3 633/4885P2RX4 399/4885P2RX2 546/4885

“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.