SCHEMBL4319062

SCHEMBL4319062

O=C(NC1(CO)CCOCC1)c1nc(-c2ccccc2C(F)(F)F)c2ccccn12

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 13/20 0.42
▸ DGAT2 Q96PD7 1/20 0.41
▸ PPARG P37231 3/20 0.39
▸ CNR2 P34972 3/20 0.38
▸ CNR1 P21554 2/20 0.38
▸ HTR4 Q13639 3/20 0.36

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
SCHEMBL4319243 0.88 DGAT2 (0.44) RORCDGAT2PPARGCNR2CNR1
SCHEMBL4326573 0.87 DGAT2 (0.43) RORCDGAT2CNR2HTR4
SCHEMBL4339631 0.87 DGAT2 (0.41) RORCDGAT2CNR2CNR1HTR4
SCHEMBL4318960 0.86 DGAT2 (0.52) RORCDGAT2CNR2CNR1HTR4
SCHEMBL4338454 0.86 DGAT2 (0.41) RORCDGAT2CNR2HTR4
SCHEMBL4332898 0.85 HIF1A (0.47) RORCDGAT2PPARGCNR2CNR1
SCHEMBL4335727 0.85 RORC (0.44) RORCDGAT2PPARGCNR2CNR1
SCHEMBL4338513 0.85 RORC (0.45) RORCDGAT2PPARGCNR2CNR1
SCHEMBL4322950 0.85 RORC (0.47) RORCDGAT2PPARG
SCHEMBL4323561 0.84 HIF1A (0.46) DGAT2CNR2HTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 — — US disclosed
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 — — US 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 (1 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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES CNR2, CNR1, TRPV1 RORC 135/4885DGAT2 2919/4885PPARG 103/4885

“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.

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