SCHEMBL6498392

SCHEMBL6498392

O=C(O)C1CCN(c2cccc(OC(F)(F)F)c2)CC1

nearest known ligand 0.85

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.85
FFAR4 Q5NUL3 3/20 0.64
CHRM2 P08172 1/20 0.58
CHRM1 P11229 1/20 0.58
PDE4A P27815 1/20 0.56
PDE4B Q07343 1/20 0.56
PDE4D Q08499 1/20 0.56
CHRM4 P08173 10/20 0.55
PDK2 Q15119 1/20 0.51

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
SCHEMBL18825893 0.88 NOTUM (0.71) NOTUMFFAR4CHRM2CHRM1CHRM4
SCHEMBL12717115 0.85 FFAR4 (0.72) NOTUMFFAR4CHRM2CHRM4
SCHEMBL6507177 0.83 NOTUM (0.64) NOTUMFFAR4CHRM2CHRM1CHRM4
SCHEMBL5798727 0.82 NOTUM (0.59) NOTUMFFAR4PDE4APDE4BPDE4D
SCHEMBL13630728 0.81 NOTUM (0.58) NOTUMFFAR4CHRM2CHRM1CHRM4
SCHEMBL4334462 0.81 NOTUM (0.85) NOTUM
SCHEMBL30173256 0.81 NOTUM (0.85) NOTUM
SCHEMBL27999922 0.81 NOTUM (0.61) NOTUMFFAR4CHRM2CHRM1CHRM4
SCHEMBL6502769 0.79 SCN9A (0.59) NOTUMFFAR4
SCHEMBL5799166 0.79 NOTUM (0.58) NOTUMPDE4APDE4BPDE4DPDK2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250340557-A1 PYRIMIDINE DERIVATIVE ASKA PHARMACEUTICAL CO., LTD. (JP) 2025-11-06 US disclosed
EP-4553068-A1 PYRIMIDINE DERIVATIVES ASKA Pharmaceutical Co., Ltd. (JP) 2025-05-14 EP disclosed
CN-119497709-A Pyrimidine derivatives ASKA 制药株式会社 2025-02-21 CN disclosed
WO-2024010015-A1 PYRIMIDINE DERIVATIVES あすか製薬株式会社 2024-01-11 WO disclosed
EP-2048132-B1 Tetrahydro-naphthalene and urea derivatives XENTION LTD (GB) 2011-04-13 EP disclosed
US-7615557-B2 Tetrahydro-naphthalene and urea derivatives XENTION LIMITED (GB) 2009-11-10 US disclosed
US-7615557-B2 Tetrahydro-naphthalene and urea derivatives XENTION LIMITED (GB) 2009-11-10 US disclosed
EP-2048132-A1 Tetrahydro-naphthalene and urea derivatives Xention Limited (GB) 2009-04-15 EP disclosed
EP-1670761-B1 TETRAHYDRO-NAPHTHALENE AND UREA DERIVATIVES XENTION LTD (GB) 2009-01-28 EP disclosed
US-20070167458-A1 Tetrahydro-naphthalene and urea derivatives BAYER HEALTHCARE AG (DE) 2007-07-19 US disclosed
US-20070167458-A1 Tetrahydro-naphthalene and urea derivatives BAYER HEALTHCARE AG (DE) 2007-07-19 US disclosed
WO-2005019200-A2 ARYL PIPERIDINE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF ICOS CORPORATION (US) 2005-03-03 WO disclosed
WO-2005019200-A2 ARYL PIPERIDINE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF ICOS CORPORATION (US) 2005-03-03 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 (2 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-20070167458-A1 Tetrahydro-naphthalene and urea derivatives NQO2, UGT1A4, CYP4B1 NOTUM 3934/4885FFAR4 2554/4885CHRM2 1842/4885
US-20250340557-A1 PYRIMIDINE DERIVATIVE PTGES, PTGS1, PTGIS NOTUM 2160/4885FFAR4 1737/4885CHRM2 2236/4885

“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.