SCHEMBL1230786

SCHEMBL1230786

Nc1ncnc2c1ncn2CCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 9/20 1.00
PI4KA P42356 3/20 0.74
PI4K2B Q8TCG2 3/20 0.74
PI4K2A Q9BTU6 3/20 0.74
PI4KB Q9UBF8 3/20 0.74
ADORA1 P30542 4/20 0.61
ADORA2B P29275 1/20 0.61
EGFR P00533 3/20 0.61
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
HPGD P15428 1/20 0.57
ALDH1A1 P00352 1/20 0.53
NSD2 O96028 3/20 0.53
NSD3 Q9BZ95 3/20 0.53

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
SCHEMBL2969651 0.92 ADORA2A (0.84) ADORA2API4KAPI4K2BPI4K2API4KB
9-Benzyl-9H-Adenine SCHEMBL104932 0.85 ADORA2A (1.00) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL13170108 0.82 ADORA2A (0.70) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL11222112 0.82 ADORA2A (0.80) ADORA2API4KAPI4K2BPI4K2API4KB
Methylglyoxal SCHEMBL6013428 0.81 ADORA2A (0.67) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL3441053 0.79 ADORA2A (0.65) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL14938326 0.78 ADORA2A (0.64) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL5033136 0.78 ADORA2A (0.73) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL2638103 0.78 ADORA2A (0.73) ADORA2API4KAPI4K2BPI4K2API4KB
SCHEMBL12006288 0.78 ADORA2A (0.63) ADORA2API4KAPI4K2BPI4K2API4KB

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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3782649-B1 BIODEGRADABLE POLYETHYLENE GLYCOL BASED WATER-INSOLUBLE HYDROGELS ASCENDIS PHARMA AS (DK) 2025-05-14 EP disclosed
US-20230381323-A1 RELEASABLE CONJUGATES FISH & RICHARDSON PC 2023-11-30 US disclosed
US-11786599-B2 Releasable conjugates QUIAPEG PHARMACEUTICALS AB (SE) 2023-10-17 US disclosed
US-20230123784-A1 Biodegradable Polyethylene Glycol Based Water-Insoluble Hydrogels ASCENDIS PHARMA A/S (DK) 2023-04-20 US disclosed
US-11559482-B2 Biodegradable polyethylene glycol based water-insoluble hydrogels ASCENDIS PHARMA A/S (DE) 2023-01-24 US disclosed
EP-4011396-A1 RELEASABLE CONJUGATES QuiaPEG Pharmaceuticals AB (SE) 2022-06-15 EP disclosed
EP-3592393-B1 RELEASABLE CONJUGATES QUIAPEG PHARMACEUTICALS AB (SE) 2021-12-01 EP disclosed
US-11116849-B2 Hydrogel-linked prodrugs releasing tagged drugs ASCENDIS PHARMA A/S (DK) 2021-09-14 US disclosed
EP-3782649-A1 BIODEGRADABLE POLYETHYLENE GLYCOL BASED WATER-INSOLUBLE HYDROGELS Ascendis Pharma A/S (DK) 2021-02-24 EP disclosed
EP-2459220-B1 BIODEGRADABLE POLYETHYLENE GLYCOL BASED WATER-INSOLUBLE HYDROGELS ASCENDIS PHARMA AS (DK) 2020-09-09 EP disclosed
WO-2013024048-A1 POLYMERIC HYPERBRANCHED CARRIER-LINKED PRODRUGS ASCENDIS PHARMA A/S (DK) 2013-02-21 WO disclosed
WO-2013024047-A1 HIGH-LOADING WATER-SOLUBLE CARRIER-LINKED PRODRUGS ASCENDIS PHARMA A/S (DK) 2013-02-21 WO disclosed
EP-1948182-B1 METHOD FOR TREATING NEURONAL AND NON-NEURONAL PAIN ZHUO MIN (CA) 2012-12-12 EP disclosed
US-20120156259-A1 Biodegradable Polyethylene Glycol Based Water-Insoluble Hydrogels ASCENDIS PHARMA A/S (DK) 2012-06-21 US disclosed
EP-2459220-A1 BIODEGRADABLE POLYETHYLENE GLYCOL BASED WATER-INSOLUBLE HYDROGELS Ascendis Pharma A/S (DK) 2012-06-06 EP disclosed
US-8124599-B2 Method for treating neuronal and non-neuronal pain FOREVER CHEER INTERNATIONAL LIMITED (HK) 2012-02-28 US disclosed
WO-2011012715-A1 BIODEGRADABLE POLYETHYLENE GLYCOL BASED WATER-INSOLUBLE HYDROGELS ASCENDIS PHARMA AS (DK) 2011-02-03 WO disclosed
US-20090233922-A1 Method for Treating Neuronal and Non-Neuronal Pain FOREVER CHEER INTERNATIONAL LIMITED (HK) 2009-09-17 US disclosed
US-20090233922-A1 Method for Treating Neuronal and Non-Neuronal Pain FOREVER CHEER INTERNATIONAL LIMITED (HK) 2009-09-17 US disclosed
WO-2007041863-A1 METHOD FOR TREATING NEURONAL AND NON-NEURONAL PAIN ZHUO MIN (CA) 2007-04-19 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 (7 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-20120156259-A1 Biodegradable Polyethylene Glycol Based Water-Insoluble Hydrogels PLG, PHYKPL, PLOD3 ADORA2A 4027/4885PI4KA 2570/4885PI4K2B 2769/4885
US-20230123784-A1 Biodegradable Polyethylene Glycol Based Water-Insoluble Hydrogels PLG, PHYKPL, PLOD3 ADORA2A 4027/4885PI4KA 2570/4885PI4K2B 2769/4885
US-20230381323-A1 RELEASABLE CONJUGATES GUSB, ABCB11, UGT2B7 ADORA2A 355/4885PI4KA 4711/4885PI4K2B 4600/4885
US-20090233922-A1 Method for Treating Neuronal and Non-Neuronal Pain OPRL1, ADCY1, GRIN1 ADORA2A 704/4885PI4KA 3231/4885PI4K2B 3474/4885
US-11559482-B2 Biodegradable polyethylene glycol based water-insoluble hydrogels PLG, PHYKPL, PLOD3 ADORA2A 4027/4885PI4KA 2570/4885PI4K2B 2769/4885
US-11786599-B2 Releasable conjugates GUSB, ABCB11, UGT2B7 ADORA2A 355/4885PI4KA 4711/4885PI4K2B 4600/4885
US-11116849-B2 Hydrogel-linked prodrugs releasing tagged drugs PTMS, PGLS, PAM ADORA2A 931/4885PI4KA 4092/4885PI4K2B 4401/4885

“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.