SCHEMBL2229602

SCHEMBL2229602

C[C@@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]c(N)nc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FUT5 Q11128 1/20 0.76
TGM2 P21980 1/20 0.70
KRAS P01116 4/20 0.66
NT5E P21589 1/20 0.66
P2RY14 Q15391 1/20 0.62
P2RX3 P56373 2/20 0.61
P2RY2 P41231 3/20 0.60
P2RY4 P51582 1/20 0.60
P2RY6 Q15077 1/20 0.60
DCPS Q96C86 1/20 0.60
P2RY1 P47900 3/20 0.57
SRC P12931 1/20 0.57
P2RX1 P51575 1/20 0.57
P2RX4 Q99571 1/20 0.57
P2RX2 Q9UBL9 1/20 0.57
ALDH1A1 P00352 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
HINT1 P49773 1/20 0.57
IMPDH2 P12268 1/20 0.57
IMPDH1 P20839 1/20 0.57

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
SCHEMBL29397556 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL14293772 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL14293912 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL29456758 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL24496886 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL9438541 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL25319857 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL14268500 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL30646155 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14
SCHEMBL29359526 1.00 FUT5 (0.76) FUT5TGM2KRASNT5EP2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025072741-A1 PRESERVATIVES FOR MOLECULAR SAMPLE ANALYSIS WITH SAMPLE COLLECTION DEVICES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 WO claimed
WO-2025072741-A1 PRESERVATIVES FOR MOLECULAR SAMPLE ANALYSIS WITH SAMPLE COLLECTION DEVICES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 WO disclosed
CN-118459756-A Temperature-sensitive material, glycoconjugate, synthesis method thereof and application of glycoconjugate in sugar solid phase synthesis 南京师范大学 2024-08-09 CN disclosed
EP-4203717-A1 CONSUMABLE Nicoventures Trading Limited (GB) 2023-07-05 EP disclosed
WO-2022043666-A1 CONSUMABLE Nicoventures Trading Limited (GB) 2022-03-03 WO disclosed
US-20130045933-A1 ALOE-EMODIN DERIVATIVES AND USE THEREOF FOR THE TREATMENT OF CANCER RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2013-02-21 US disclosed
WO-2011089602-A2 ALOE-EMODIN DERIVATIVES AND USE THEREOF FOR THE TREATMENT OF CANCER RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2011-07-28 WO disclosed
US-5939290-A Modified sialyl Lewisx compounds ALBERTA RESEARCH COUNCIL (CA) 1999-08-17 US disclosed
US-5882901-A SIALYLATING SPECIFIED OLIGOSACCHARIDE WITH SIALYLTRANSFERASE, FUCOSYLATING WITH FUCOSYLTRANSFERASE ALBERTA RESEARCH COUNCIL (CA) 1999-03-16 US disclosed
US-5872096-A MODULATION OF A CELL MEDIATED IMMUNE RESPONSE, USED TO PREPARE ARTIFICIAL ANTIGENS FOR THE GENERATION OF MONOCLONAL OR POLYCLONAL ANTIBODIES ALBERTA RESEARCH COUNCIL (CA) 1999-02-16 US disclosed
US-5759993-A OLIGOSACCHARIDES AS IMMUNOMODULATORS ALBERTA RESEARCH COUNCIL (CA) 1998-06-02 US disclosed
US-5646123-A Time dependent administration of oligosaccharide glycosides related to blood group determinants having a type I or type II core structure in reducing inflammation in a sensitized mammal arising form exposure to an antigen ALBERTA RESEARCH COUNCIL (CA) 1997-07-08 US disclosed
US-5580858-A Immunosuppressive and tolerogenic modified Lewisx compounds ALBERTA RESEARCH COUNCIL (CA) 1996-12-03 US disclosed
WO-1993024505-A1 REDUCING INFLAMMATION BY TIME DEPENDENT ADMINISTRATION OF OLIGOSACCHARIDES GLYCOSIDES RELATED TO BLOOD GROUP DETERMINANTS ALBERTA RESEARCH COUNCIL (CA) 1993-12-09 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-20130045933-A1 ALOE-EMODIN DERIVATIVES AND USE THEREOF FOR THE TREATMENT OF CANCER GALE, SLC1A5, ABCC1 FUT5 24/4885TGM2 1672/4885KRAS 907/4885

“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.