SCHEMBL4953064

SCHEMBL4953064

O=C(COc1ccc(C(F)(F)F)cc1)N1CCC2(CC1)C(=O)Nc1ccccc12

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 5/20 0.52
▸ MDH1 P40925 1/20 0.47
▸ MDH2 P40926 1/20 0.47
▸ PDK2 Q15119 5/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ TSHR P16473 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ OPRM1 P35372 1/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ OPRL1 P41146 1/20 0.43
▸ GHSR Q92847 1/20 0.42
▸ ALDH1A1 P00352 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
SCHEMBL4953381 0.89 ALDH1A1 (0.56) ENPP2PDK2MEN1KMT2ATSHR
SCHEMBL4949410 0.89 FKBP1A (0.52) ENPP2MEN1KMT2ALMNAMAPT
SCHEMBL4951646 0.88 MEN1 (0.58) MEN1KMT2ALMNAHTTOPRM1
SCHEMBL4951152 0.86 HTR1A (0.55) ENPP2MEN1KMT2ALMNAMAPT
SCHEMBL4953715 0.86 MAPT (0.54) MEN1KMT2ALMNAMAPTHTT
SCHEMBL4952232 0.86 GHSR (0.57) MEN1KMT2ALMNAMAPTHTT
SCHEMBL13994626 0.86 MEN1 (0.47) MEN1KMT2ALMNAOPRM1OPRK1
SCHEMBL13994637 0.85 PARP1 (0.43) ENPP2PDK2MEN1KMT2ALMNA
SCHEMBL4953825 0.85 PARP1 (0.43) ENPP2PDK2MEN1KMT2ALMNA
SCHEMBL4951161 0.84 FKBP1A (0.54) MEN1KMT2ALMNAMAPTOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306102-A1 NOVEL SPIROOXYINDOLE COMPOUNDS AND DRUGS CONTAINING SAME KOWA CO., LTD. (JP) 2008-12-11 — — US disclosed
US-20080306102-A1 NOVEL SPIROOXYINDOLE COMPOUNDS AND DRUGS CONTAINING SAME KOWA CO., LTD. (JP) 2008-12-11 — — US disclosed
US-20080306102-A1 NOVEL SPIROOXYINDOLE COMPOUNDS AND DRUGS CONTAINING SAME KOWA CO., LTD. (JP) 2008-12-11 — — 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-20080306102-A1 NOVEL SPIROOXYINDOLE COMPOUNDS AND DRUGS CONTAINING SAME HSD11B1, HSD11B2, HSD3B1 ENPP2 3541/4885MDH1 377/4885MDH2 324/4885

“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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