SCHEMBL2675833

SCHEMBL2675833

CC1(C)OC2C(COS(=O)(=O)O)OC(n3cnc4c(=O)[nH]c(N)nc43)C2O1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.57
HINT1 P49773 5/20 0.55
APOBEC3G Q9HC16 1/20 0.54
HPGD P15428 1/20 0.51
NT5E P21589 1/20 0.49
PNP P00491 1/20 0.49
KRAS P01116 1/20 0.48
PI4KA P42356 1/20 0.48
PI4K2B Q8TCG2 1/20 0.48
PI4K2A Q9BTU6 1/20 0.48
PI4KB Q9UBF8 1/20 0.48
GSK3A P49840 2/20 0.47
RPS6KA3 P51812 2/20 0.47
MAPK14 Q16539 2/20 0.47
P2RX1 P51575 1/20 0.47
P2RX3 P56373 1/20 0.47
P2RX4 Q99571 1/20 0.47
TGM2 P21980 1/20 0.46

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
SCHEMBL19941645 0.93 RXFP1 (0.59) RXFP1HINT1APOBEC3GHPGDNT5E
SCHEMBL19941646 0.93 RXFP1 (0.59) RXFP1HINT1APOBEC3GHPGDNT5E
SCHEMBL19922931 0.93 RXFP1 (0.59) RXFP1HINT1APOBEC3GHPGDNT5E
SCHEMBL19938134 0.93 RXFP1 (0.59) RXFP1HINT1APOBEC3GHPGDNT5E
SCHEMBL19938137 0.93 RXFP1 (0.59) RXFP1HINT1APOBEC3GHPGDNT5E
SCHEMBL2675838 0.91 RXFP1 (0.67) RXFP1HINT1APOBEC3GHPGDNT5E
SCHEMBL19941619 0.86 HINT1 (0.76) RXFP1HINT1APOBEC3GHPGDPNP
SCHEMBL19938153 0.86 HINT1 (0.76) RXFP1HINT1APOBEC3GHPGDPNP
SCHEMBL19941620 0.86 HINT1 (0.76) RXFP1HINT1APOBEC3GHPGDPNP
SCHEMBL19922943 0.86 PI4KA (0.64) HINT1HPGDNT5EPI4KAPI4K2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173797-B2 Sulfated nucleoside derivatives including ribonucleoside mono- and disulfates derived from guanine, adenosine, and cytidine CORNELL RESEARCH FOUNDATION, INC. (US) 2012-05-08 US disclosed
US-8173797-B2 Sulfated nucleoside derivatives including ribonucleoside mono- and disulfates derived from guanine, adenosine, and cytidine CORNELL RESEARCH FOUNDATION, INC. (US) 2012-05-08 US disclosed
US-8173797-B2 Sulfated nucleoside derivatives including ribonucleoside mono- and disulfates derived from guanine, adenosine, and cytidine CORNELL RESEARCH FOUNDATION, INC. (US) 2012-05-08 US disclosed
US-20080193452-A1 Therapeutic Compounds Derived from Spider Venom and Their Method of Use CORNELL RESEARCH FOUNDATION, INC. (US) 2008-08-14 US disclosed
US-20080193452-A1 Therapeutic Compounds Derived from Spider Venom and Their Method of Use CORNELL RESEARCH FOUNDATION, INC. (US) 2008-08-14 US disclosed
US-20080193452-A1 Therapeutic Compounds Derived from Spider Venom and Their Method of Use CORNELL RESEARCH FOUNDATION, INC. (US) 2008-08-14 US disclosed
WO-2006130161-A2 THERAPEUTIC COMPOUNDS DERIVED FROM SPIDER VENOM AND THEIR METHOD OF USE THE CORNELL RESEARCH FOUNDATION, INC. (US) 2006-12-07 WO 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-20080193452-A1 Therapeutic Compounds Derived from Spider Venom and Their Method of Use ADAR, FUT5, CSGALNACT1 RXFP1 3050/4885HINT1 920/4885APOBEC3G 96/4885

“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.