SCHEMBL21189396

SCHEMBL21189396

O=C(Cl)c1ccc(F)c2c1SCCC2=O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
VHL P40337 1/20 0.33
ELOC Q15369 1/20 0.33
ELOB Q15370 1/20 0.33
NOTUM Q6P988 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL19973994 0.85 DGAT1 (0.36) VHLELOCELOBNOTUMCES2
SCHEMBL19973951 0.84 ALDH1A1 (0.38) ALDH1A1ALOX15NOTUMCES2CES1
SCHEMBL28914080 0.81 ALDH1A1 (0.31) ALDH1A1CES2
SCHEMBL14053008 0.80 VHL (0.37) VHLELOCELOBNOTUM
SCHEMBL21189321 0.72 VHL (0.38) ALDH1A1ALOX15VHLELOCELOB
SCHEMBL5450432 0.67 ABL1 (0.37) ALDH1A1
SCHEMBL8308598 0.67 ALDH1A1 (0.36) ALDH1A1ALOX15CES2CES1
SCHEMBL8136278 0.65 KDM4E (0.34) ALDH1A1NOTUM
SCHEMBL8346491 0.63 VHL (0.41) ALDH1A1VHLELOCELOBCES1
SCHEMBL7840446 0.63 BRD4 (0.34) ALDH1A1VHLELOCELOB

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-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same ARBUTUS BIOPHARMA CORPORATION (CA) 2021-05-11 US disclosed
US-20190225593-A1 SUBSTITUTED CHROMANE-8-CARBOXAMIDE COMPOUNDS AND ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORP (CA) 2019-07-25 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 (2 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-20190225593-A1 SUBSTITUTED CHROMANE-8-CARBOXAMIDE COMPOUNDS AND ANALOGUES THEREOF, AND METHODS USING SAME CBX8, HAVCR2, HCCS ALDH1A1 3241/4885ALOX15 4718/4885VHL 164/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS ALDH1A1 3241/4885ALOX15 4718/4885VHL 164/4885

“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.