SCHEMBL4290255

SCHEMBL4290255

CN(C)c1ncccc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 2/20 0.58
KDM4E B2RXH2 3/20 0.57
TDP1 Q9NUW8 1/20 0.57
ALDH1A1 P00352 8/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
ALOX15 P16050 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
CYP3A4 P08684 1/20 0.55
MAPT P10636 1/20 0.55
TSHR P16473 1/20 0.55
BLM P54132 1/20 0.55
AGER Q15109 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
LMNA P02545 3/20 0.53
MYC P01106 1/20 0.53
DHODH Q02127 1/20 0.46
GAA P10253 2/20 0.44
KMT2A Q03164 1/20 0.43
ALOX12 P18054 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL29448035 1.00 NAPRT (0.58) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL3463758 0.98 NAPRT (0.56) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL2179960 0.85 NAPRT (0.55) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL24963302 0.85 NAPRT (0.44) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL7342181 0.83 NAPRT (0.43) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL2770958 0.83 PARP1 (0.51) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL10427732 0.82 NAPRT (0.51) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
Lithium Ion SCHEMBL3463755 0.81 NAPRT (0.42) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL16967455 0.81 NAPRT (0.50) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL26054706 0.80 NAPRT (0.41) NAPRTKDM4ETDP1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1904474-A1 NEW PYRIDINE ANALOGUES AstraZeneca AB (SE) 2008-04-02 EP claimed
WO-2007008140-A1 NEW PYRIDINE ANALOGUES ASTRAZENECA AB (SE) 2007-01-18 WO claimed
US-12473290-B2 Imidazopyridazine compounds useful as modulators of IL-12, IL-23 and/or IFN alpha responses BRISTOL MYERS-SQUIBB COMPANY (US) 2025-11-18 US disclosed
EP-3935058-B1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2024-08-21 EP disclosed
US-20230183242-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL-MYERS SQUIBB COMPANY 2023-06-15 US disclosed
US-11219593-B2 Yarrow fresh-plant pressed juice concentrate, production, and use SYMRISE AG (DE) 2022-01-11 US disclosed
EP-3564217-B1 P2X4 RECEPTOR ANTAGONIST NIPPON CHEMIPHAR CO (JP) 2021-01-27 EP disclosed
EP-3675809-A1 USE OF PHYSIOLOGICAL COOLING ACTIVE INGREDIENTS, AND COMPOSITIONS COMPRISING SUCH ACTIVE INGREDIENTS BASF SE (DE) 2020-07-08 EP disclosed
US-20200188290-A1 YARROW FRESH-PLANT PRESSED JUICE CONCENTRATE, PRODUCTION, AND USE SYMRISE AG (DE) 2020-06-18 US disclosed
CN-110573141-A Concentrate of freshly squeezed plant juice of milfoil, its production and use 西姆莱斯有限公司 2019-12-13 CN disclosed
US-10472333-B2 P2X4 receptor antagonist NIPPON CHEMIPHAR CO., LTD. (JP) 2019-11-12 US disclosed
US-10150744-B2 P2X4 receptor antagonist NIPPON CHEMIPHAR CO., LTD (JP) 2018-12-11 US disclosed
US-20180319752-A1 P2X4 RECEPTOR ANTAGONIST NIPPON CHEMIPHAR CO., LTD. (JP) 2018-11-08 US disclosed
EP-2804868-B1 PYRAN-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMA (US) 2017-04-12 EP disclosed
US-20170081294-A1 P2X4 RECEPTOR ANTAGONIST NIPPON CHEMIPHAR CO., LTD. (JP) 2017-03-23 US disclosed
EP-3020707-A1 P2X4 RECEPTOR ANTAGONIST Nippon Chemiphar Co., Ltd. (JP) 2016-05-18 EP disclosed
US-20090156485-A1 METHOD FOR COUPLING KERATIN-BINDING POLYPEPTIDES WITH EFFECTOR MOLECULES WHICH SUPPORT CARBOXYLIC GROUPS OR SULFONIC ACID GROUPS BASE SE (DE) 2009-06-18 US disclosed
EP-1904474-A1 NEW PYRIDINE ANALOGUES AstraZeneca AB (SE) 2008-04-02 EP disclosed
CN-101073781-A 4-dimethy-pyridine organic molecular-catalyst containing dinaphthalene chiral functional based and its production UNIV TIANJIN (CN) 2007-11-21 CN disclosed
WO-2007008140-A1 NEW PYRIDINE ANALOGUES ASTRAZENECA AB (SE) 2007-01-18 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-20170081294-A1 P2X4 RECEPTOR ANTAGONIST P2RX2, P2RX1, P2RX4 NAPRT 1513/4885KDM4E 2443/4885TDP1 3394/4885
US-20230183242-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES TYK2, JAK3, IFNAR1 NAPRT 4191/4885KDM4E 2322/4885TDP1 1157/4885
US-10472333-B2 P2X4 receptor antagonist P2RX2, P2RX1, P2RX3 NAPRT 1673/4885KDM4E 2458/4885TDP1 3056/4885
US-20090156485-A1 METHOD FOR COUPLING KERATIN-BINDING POLYPEPTIDES WITH EFFECTOR MOLECULES WHICH SUPPORT CARBOXYLIC GROUPS OR SULFONIC ACID GROUPS KRT18, KRTCAP2, CUTA NAPRT 4162/4885KDM4E 1850/4885TDP1 4744/4885
US-10150744-B2 P2X4 receptor antagonist P2RX2, P2RX1, P2RX4 NAPRT 1513/4885KDM4E 2443/4885TDP1 3394/4885
US-20180319752-A1 P2X4 RECEPTOR ANTAGONIST P2RX2, P2RX1, P2RX3 NAPRT 1673/4885KDM4E 2458/4885TDP1 3056/4885
US-12473290-B2 Imidazopyridazine compounds useful as modulators of IL-12, IL-23 and/or IFN alpha responses TYK2, JAK3, IFNAR1 NAPRT 4191/4885KDM4E 2322/4885TDP1 1157/4885

“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.