SCHEMBL22987095

SCHEMBL22987095

COC(=O)c1cc(C(F)(F)F)c(N)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.60
▸ KDM4E B2RXH2 4/20 0.58
▸ CFTR P13569 8/20 0.56
▸ POLB P06746 1/20 0.46
▸ MAPT P10636 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ GLA P06280 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ CASP7 P55210 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ NOTUM Q6P988 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ ESRRA P11474 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40

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
SCHEMBL22987089 0.86 ALDH1A1 (0.50) GAAKDM4ECFTRALDH1A1HSD17B10
SCHEMBL8102763 0.85 CFTR (0.49) GAAKDM4ECFTRPOLBMAPT
SCHEMBL1763669 0.83 APP (0.48) GAAKDM4ECFTRPOLBALDH1A1
SCHEMBL168616 0.83 CFTR (0.47) GAAKDM4ECFTRPOLBMAPT
SCHEMBL6473999 0.81 GAA (0.74) GAAKDM4ECFTRPOLBMAPT
SCHEMBL29424850 0.81 GAA (0.74) GAAKDM4ECFTRPOLBMAPT
SCHEMBL31603104 0.81 CFTR (0.68) GAAKDM4ECFTRPOLBMAPT
SCHEMBL21822936 0.81 NOTUM (0.55) GAAKDM4ECFTRPOLBMAPT
SCHEMBL2031824 0.81 CFTR (0.60) GAAKDM4ECFTRPOLBMAPT
SCHEMBL11568484 0.80 KDM4E (0.76) GAAKDM4ECFTRPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3586838-B1 AMIDE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2021-10-27 — — EP disclosed
EP-3586838-B1 AMIDE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2021-10-27 — — EP disclosed
US-10925848-B2 Amide derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-02-23 — — US disclosed
US-10925848-B2 Amide derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-02-23 — — 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-10925848-B2 Amide derivative IDO1, IDO2, TPH1 GAA 1221/4885KDM4E 2941/4885CFTR 2319/4885

“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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