SCHEMBL14744263

SCHEMBL14744263

FC(F)(F)Oc1ccc(C2CNC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
KDM1A O60341 1/20 0.43
RCOR1 Q9UKL0 1/20 0.43
HTR2C P28335 3/20 0.43
SLC6A4 P31645 1/20 0.40
NISCH Q9Y2I1 1/20 0.40
EPHX1 P07099 1/20 0.39
PIM1 P11309 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ATM Q13315 1/20 0.38
MAPT P10636 1/20 0.38
EPHX2 P34913 1/20 0.38
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL25307338 0.86 HTR3A (0.54) SCN10AHTR2CEPHX1
SCHEMBL22944159 0.84 SCN10A (0.61) SCN10AHTR2C
SCHEMBL23149005 0.82 ESRRG (0.36) SCN10AL3MBTL1KDM1ARCOR1HTR2C
SCHEMBL4564168 0.82 L3MBTL1 (0.47) L3MBTL1KDM1ARCOR1HTR2CSLC6A4
SCHEMBL2298335 0.81 HTR2C (0.61) SCN10AL3MBTL1HTR2CNISCHEPHX1
SCHEMBL25253614 0.81 SCN10A (0.43) SCN10AHTR2CSLC6A4MEN1KMT2A
SCHEMBL29496957 0.81 SCN10A (0.43) SCN10AHTR2CSLC6A4MEN1KMT2A
Hydrochloric Acid SCHEMBL4893644 0.80 HTR2C (0.62) SCN10AL3MBTL1KDM1ARCOR1HTR2C
SCHEMBL20757498 0.79 HTR2C (0.44) HTR2CSLC6A4PIM1PIM2
SCHEMBL28247613 0.78 MEN1 (0.48) SCN10AL3MBTL1KDM1ARCOR1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12110294-B2 CD73 compounds GILEAD SCIENCES, INC. (US) 2024-10-08 US disclosed
US-20240043427-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. 2024-02-08 US disclosed
EP-4143194-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-03-08 EP disclosed
US-20230039553-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. 2023-02-09 US disclosed
CN-115698009-A CD73 inhibiting 2,4-dioxopyrimidine compounds 吉利德科学公司 2023-02-03 CN disclosed
US-11253499-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-02-22 US disclosed
EP-3668854-B1 NOVEL COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2022-01-12 EP disclosed
WO-2021222522-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2021-11-04 WO disclosed
EP-3293184-B1 PYRIMIDINE CARBOXAMIDES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA LP (US) 2020-12-16 EP disclosed
EP-3293184-B1 PYRIMIDINE CARBOXAMIDES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA LP (US) 2020-12-16 EP disclosed
US-9163008-B2 Pyrimidines as sodium channel blockers PURDUE PHARMA, L.P. (US) 2015-10-20 US disclosed
US-9163008-B2 Pyrimidines as sodium channel blockers PURDUE PHARMA, L.P. (US) 2015-10-20 US disclosed
US-9163008-B2 Pyrimidines as sodium channel blockers PURDUE PHARMA, L.P. (US) 2015-10-20 US disclosed
US-20140303139-A1 PYRIMIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. 2014-10-09 US disclosed
US-20140303139-A1 PYRIMIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. 2014-10-09 US disclosed
US-20140303139-A1 PYRIMIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. 2014-10-09 US disclosed
WO-2014135955-A1 PYRIMIDINE CARBOXAMIDES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2014-09-12 WO disclosed
WO-2014135955-A1 PYRIMIDINE CARBOXAMIDES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2014-09-12 WO disclosed
WO-2013030665-A1 PYRIMIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2013-03-07 WO disclosed
WO-2013030665-A1 PYRIMIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2013-03-07 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-20230039553-A1 CD73 COMPOUNDS ENTPD5, ENTPD1, NT5E SCN10A 1945/4885L3MBTL1 3951/4885KDM1A 2052/4885
US-11253499-B2 Compounds SDHA, SDHB, FDPS SCN10A 4470/4885L3MBTL1 1628/4885KDM1A 4129/4885
US-20240043427-A1 CD73 COMPOUNDS ENTPD5, ENTPD1, NT5E SCN10A 1945/4885L3MBTL1 3951/4885KDM1A 2052/4885
US-12110294-B2 CD73 compounds ENTPD5, ENTPD1, NT5E SCN10A 1690/4885L3MBTL1 4253/4885KDM1A 1870/4885
US-20140303139-A1 PYRIMIDINES AS SODIUM CHANNEL BLOCKERS P2RX1, P2RX4, P2RX2 SCN10A 37/4885L3MBTL1 1285/4885KDM1A 2901/4885

“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.