SCHEMBL5655447

SCHEMBL5655447

CON(C)OC(=O)c1ccc(C)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ CFTR P13569 3/20 0.35
▸ NOTUM Q6P988 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ PDK2 Q15119 1/20 0.34
▸ THRA P10827 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ GAA P10253 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ SYK P43405 1/20 0.33

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
SCHEMBL13948877 0.82 CFTR (0.51) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL27972781 0.77 CES2 (0.42) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL14860095 0.76 CES2 (0.41) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL13166715 0.75 KMT2A (0.46) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL16723454 0.75 ALDH1A1 (0.48) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL28471721 0.74 CES2 (0.48) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL107636 0.74 CSNK2A1 (0.52) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL7787350 0.73 CES2 (0.47) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL18398755 0.72 SMN1; SMN2 (0.45) CES2SMN1; SMN2TP53MAPTRAB9A
SCHEMBL4620600 0.72 CES2 (0.46) CES2SMN1; SMN2TP53MAPTRAB9A

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-7262185-B2 Benzazepine derivative, process for producing the same, and use TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2007-08-28 — — US disclosed
US-20040235822-A1 Benzazepine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-11-25 — — US disclosed
EP-1422228-A1 BENZAZEPINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Chemical Industries, Ltd. (JP) 2004-05-26 — — EP 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-20040235822-A1 Benzazepine derivative, process for producing the same, and use CYP1B1, CYP1A1, CYP2E1 CES2 718/4885SMN1; SMN2 1174/4885TP53 4651/4885

“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.

Send feedback