SCHEMBL1672180

SCHEMBL1672180

Nc1nc2c(c(=O)[nH]1)NCN2CC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 8/20 0.56
NOS1 P29475 7/20 0.36
PNP P00491 2/20 0.34
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
USP2 O75604 1/20 0.33
CASP7 P55210 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PAH P00439 1/20 0.33

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
SCHEMBL5250159 0.86 HPRT1 (0.60) HPRT1NOS1PNP
Adamantane SCHEMBL10430835 0.84 HPRT1 (0.52) HPRT1NOS1
SCHEMBL1672306 0.84 HPRT1 (0.41) HPRT1HSD17B10
SCHEMBL10917986 0.84 HPRT1 (0.52) HPRT1NOS1PNPNOS3NOS2
SCHEMBL9739844 0.84 HPRT1 (0.60) HPRT1NOS1PNPNOS3NOS2
SCHEMBL22799106 0.83 HPRT1 (0.57) HPRT1NOS1PNPUSP2HSD17B10
SCHEMBL21637016 0.82 HPRT1 (0.57) HPRT1NOS1PNPNOS3NOS2
SCHEMBL10919938 0.82 HPRT1 (0.54) HPRT1NOS1USP2CASP7HSD17B10
SCHEMBL8529902 0.81 HPRT1 (0.58) HPRT1NOS1PNPUSP2CASP7
SCHEMBL10919925 0.81 HPRT1 (0.53) HPRT1NOS1USP2CASP7HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200292535-A1 METHOD FOR EVALUATION OF TARGET IN HISTOLOGICAL SAMPLE DAKO DENMARK A/S (DK) 2020-09-17 US disclosed
US-10648970-B2 Method for evaluation of target in histological sample AGILENT TECHNOLOGIES, INC. (US) 2020-05-12 US disclosed
EP-2646795-B1 METHODS FOR ANALYZING IMAGES OF SPECIMENS PROCESSED BY A PROGRAMMABLE QUANTITATIVE ASSAY DAKO DENMARK AS (DK) 2019-02-20 EP disclosed
US-10180426-B2 Quantification of single target molecules in histological samples DAKO DENMARK A/S (DK) 2019-01-15 US disclosed
EP-3402897-A1 SUBSTRATES, SYSTEMS, AND METHODS FOR NUCLEIC ACID ARRAY SYNTHESIS Vibrant Holdings, LLC (US) 2018-11-21 EP disclosed
US-9970874-B2 Methods and systems for analyzing images of specimens processed by a programmable quantitative assay DAKO DENMARK A/S (DK) 2018-05-15 US disclosed
US-9958449-B2 Method for enzyme-mediated signal amplification DAKO DENMARK A/S (DK) 2018-05-01 US disclosed
EP-2699691-B1 NEW METHOD FOR ENZYME-MEDIATED SIGNAL AMPLIFICATION DAKO DENMARK AS (DK) 2017-10-18 EP disclosed
WO-2017117292-A1 SUBSTRATES, SYSTEMS, AND METHODS FOR NUCLEIC ACID ARRAY SYNTHESIS VIBRANT HOLDINGS, LLC (US) 2017-07-06 WO disclosed
US-9671400-B2 Conjugate molecules DAKO DENMARK A/S (DK) 2017-06-06 US disclosed
CN-1642923-A Peptide nucleic acid oligomers from 1-benzenesulfonyl-3-amino acid side chain-4-(2-nucleobase(acetyl))-piperazin-2-ones PANAGENE INC (KR) 2005-07-20 CN disclosed
EP-1470114-A4 PEPTIDE NUCLEIC ACID OLIGOMERS FROM 1-BENZENESULFONYL-3-AMINO ACID SIDE CHAIN-4-(2-NUCLEOBASE(ACETYL))-PIPERAZIN-2-ONES PANAGENE INC (KR) 2005-05-11 EP disclosed
US-20050026930-A1 PNA monomer and precursor PANAGENE, INC. (KR) 2005-02-03 US disclosed
WO-2005009998-A1 PNA MONOMER AND PRECURSOR PANAGENE INC. (US) 2005-02-03 WO disclosed
EP-1501812-A1 PNA MONOMER AND PRECURSOR Panagene, Inc. (KR) 2005-02-02 EP disclosed
EP-1470114-A1 PEPTIDE NUCLEIC ACID OLIGOMERS FROM 1-BENZENESULFONYL-3-AMINO ACID SIDE CHAIN-4-(2-NUCLEOBASE(ACETYL))-PIPERAZIN-2-ONES Panagene, Inc. (KR) 2004-10-27 EP disclosed
US-20030225252-A1 PNA monomer and precursor PANAGENE, INC. (KR) 2003-12-04 US disclosed
WO-2003091231-A1 PNA MONOMER AND PRECURSOR PANAGENE, INC. (US) 2003-11-06 WO disclosed
US-20030195332-A1 PNA monomer and precursor PANAGENE, INC. (KR) 2003-10-16 US disclosed
WO-2003062212-A1 PEPTIDE NUCLEIC ACID OLIGOMERS FROM 1-BENZENESULFONYL-3-AMINO ACID SIDE CHAIN-4-(2-NUCLEOBASE(ACETYL))-PIPERAZIN-2-ONES PANAGENE, INC. (US) 2003-07-31 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 (3 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-20030195332-A1 PNA monomer and precursor RNGTT, NGLY1, NCL HPRT1 432/4885NOS1 72/4885PNP 44/4885
US-20030225252-A1 PNA monomer and precursor PNISR, RNGTT, NCL HPRT1 377/4885NOS1 192/4885PNP 77/4885
US-20050026930-A1 PNA monomer and precursor RNGTT, POLL, NSUN3 HPRT1 565/4885NOS1 271/4885PNP 340/4885

“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.