SCHEMBL179869

SCHEMBL179869

O=C(O)OC(=O)c1ncc[nH]1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
GLA P06280 1/20 0.37
TBXAS1 P24557 2/20 0.35
BRAF P15056 1/20 0.34
HDAC1 Q13547 1/20 0.34
MTOR P42345 1/20 0.31
ADK P55263 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
HSPA5 P11021 1/20 0.31

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
SCHEMBL31229951 0.90 NPC1 (0.47) NPC1RAB9AKMT2ASMN1; SMN2HTT
SCHEMBL6765328 0.85 NPC1 (0.42) NPC1RAB9AKMT2ASMN1; SMN2HTT
SCHEMBL1150474 0.82 NPC1 (0.43) NPC1RAB9AKMT2ASMN1; SMN2HTT
SCHEMBL28554259 0.79 NPC1 (0.44) NPC1RAB9AKMT2ASMN1; SMN2HTT
SCHEMBL29014453 0.78 NPC1 (0.40) NPC1RAB9AKMT2ASMN1; SMN2HTT
SCHEMBL6270339 0.78
SCHEMBL5317101 0.78
SCHEMBL262815 0.78
SCHEMBL41312 0.76
SCHEMBL11411711 0.76 RAB9A (0.41) NPC1RAB9AKMT2ASMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7034061-B1 Non-thrombogenic and anti-thrombogenic polymers BIOINTERACTIONS LTD. (GB) 2006-04-25 US claimed
EP-0896600-B1 NON-THROMBOGENIC AND ANTI-THROMBOGENIC POLYMERS LUTHRA AJAY KUMAR (GB) 2000-01-12 EP claimed
EP-0896600-A1 NON-THROMBOGENIC AND ANTI-THROMBOGENIC POLYMERS Luthra, Ajay Kumar (GB) 1999-02-17 EP claimed
WO-1997041164-A1 NON-THROMBOGENIC AND ANTI-THROMBOGENIC POLYMERS LUTHRA AJAY KUMAR (GB) 1997-11-06 WO claimed
US-12016952-B2 Methods of preparing a monodisperse oligo(ethylene glycol) reagent composition NEKTAR THERAPEUTICS (US) 2024-06-25 US disclosed
US-11464788-B2 Oligomer-corticosteroid conjugates NEKTAR THERAPEUTICS (US) 2022-10-11 US disclosed
US-20220072010-A1 OLIGOMER-CORTICOSTEROID CONJUGATES NEKTAR THERAPEUTICS (US) 2022-03-10 US disclosed
US-20210401998-A1 METHODS OF TREATING CYP2D6 ALTERNATIVE METABOLIZERS NEKTAR THERAPEUTICS (US) 2021-12-30 US disclosed
US-20210393513-A1 CHEMICALLY MODIFIED SMALL MOLECULES REDHILL BIOPHARMA LTD. (IL) 2021-12-23 US disclosed
EP-2627639-B1 N-OPTIONALLY SUBSTITUTED ARYL-2-OLIGOMER-3-ALKOXYPROPIONAMIDES NEKTAR THERAPEUTICS (US) 2021-12-22 EP disclosed
US-11129794-B2 Chemically modified small molecules NEKTAR THERAPEUTICS (US) 2021-09-28 US disclosed
US-11033631-B2 Methods of treating CYP2D6 alternative metabolizers NEKTAR THERAPEUTICS (US) 2021-06-15 US disclosed
US-6406687-B1 POLYOXYALKYLENE ETHER, SULFATE, SULFONATE AND SULFAMATE AS ANTICOAGULANTS BIOINTERACTIONS LTD. (GB) 2002-06-18 US disclosed
US-6096798-A COATING MATERIALS FOR MEDICAL DEVICES, SUCH AS TUBING OR CONNECTORS BIOINTERACTIONS LTD. (GB) 2000-08-01 US disclosed
EP-0896600-B1 NON-THROMBOGENIC AND ANTI-THROMBOGENIC POLYMERS LUTHRA AJAY KUMAR (GB) 2000-01-12 EP disclosed
WO-1999056126-A2 IMMUNO-ADSORPTION MATRIX, A METHOD FOR THE PRODUCTION THEREOF, AND THE UTILIZATION THEREOF AFFINA IMMUNTECHNIK GMBH (DE) 1999-11-04 WO disclosed
EP-0938340-A2 METHOD FOR PREPARING BIOACTIVE POLYMERS Bar Ilan University (IL) 1999-09-01 EP disclosed
EP-0896600-A1 NON-THROMBOGENIC AND ANTI-THROMBOGENIC POLYMERS Luthra, Ajay Kumar (GB) 1999-02-17 EP disclosed
WO-1998002189-A2 METHOD FOR PREPARING BIOACTIVE POLYMERS BAR ILAN UNIVERSITY (IL) 1998-01-22 WO disclosed
WO-1997041164-A1 NON-THROMBOGENIC AND ANTI-THROMBOGENIC POLYMERS LUTHRA AJAY KUMAR (GB) 1997-11-06 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 (5 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-11129794-B2 Chemically modified small molecules H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CD44, ELANE NPC1 1623/4885RAB9A 1241/4885KMT2A 1374/4885
US-20210393513-A1 CHEMICALLY MODIFIED SMALL MOLECULES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CD44, PLG NPC1 2189/4885RAB9A 1783/4885KMT2A 1395/4885
US-11464788-B2 Oligomer-corticosteroid conjugates SERPINA6, NR3C2, NR3C1 NPC1 585/4885RAB9A 4269/4885KMT2A 4574/4885
US-20220072010-A1 OLIGOMER-CORTICOSTEROID CONJUGATES SERPINA6, NR3C2, NR3C1 NPC1 585/4885RAB9A 4269/4885KMT2A 4574/4885
US-12016952-B2 Methods of preparing a monodisperse oligo(ethylene glycol) reagent composition POLM, OGG1, COPE NPC1 2566/4885RAB9A 3926/4885KMT2A 4052/4885

“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.