SCHEMBL5745449

SCHEMBL5745449

COC(C)(NC(=O)Cl)OC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
DGAT1 O75907 1/20 0.31

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
SCHEMBL6399290 0.76 ALDH1A1 (0.33) ALDH1A1DGAT1
SCHEMBL6759439 0.74 CRBN (0.32) ALDH1A1DGAT1
Hydrochloric Acid SCHEMBL5745453 0.74 ALDH1A1 (0.32) ALDH1A1DGAT1
SCHEMBL8826965 0.73 ALDH1A1 (0.34) ALDH1A1
SCHEMBL5219501 0.71
SCHEMBL3025 0.69
SCHEMBL27737320 0.69 ALDH1A1 (0.50) ALDH1A1
SCHEMBL11093167 0.69
SCHEMBL8550237 0.69
SCHEMBL28207423 0.69 ALDH1A1 (0.42) ALDH1A1

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-0857726-B1 1H-pyrrolo-¬1,2-b|¬1,2,4|triazole compound and its synthetic intermediate, and method of preparing a 1H-1,2,4-trazole-5-yl-acetic acid ester compound FUJI PHOTO FILM CO LTD (JP) 2006-06-14 EP disclosed
US-20020107399-A1 1H-pyrrolo-[1,2,-b] [1,2,4] triazole compound and its synthetic intermediate, and method of preparing A 1H-1,2,4-triazole-5-yl-acetic acid FUJI PHOTO FILM CO., LTD. 2002-08-08 US disclosed
US-6384219-B1 PHOTOGRAPHIC CYAN COUPLERS; CYCLIZATION AND DEACETYLATION OF THE CYANOALKYL ESTER WITH AN ACID HALIDE FUJI PHOTO FILM CO., LTD. (JP) 2002-05-07 US disclosed
EP-0857726-A1 1H-pyrrolo-[1,2-b][1,2,4]triazole compound and its synthetic intermediate, and method of preparing a 1H-1,2,4-trazole-5-yl-acetic acid ester compound FUJI PHOTO FILM CO., LTD. (JP) 1998-08-12 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-20020107399-A1 1H-pyrrolo-[1,2,-b] [1,2,4] triazole compound and its synthetic intermediate, and method of preparing A 1H-1,2,4-triazole-5-yl-acetic acid PYM1, ABAT, NPY1R ALDH1A1 438/4885DGAT1 1545/4885

“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.