SCHEMBL21189435

SCHEMBL21189435

O=C1CC[C@@H](COC(=O)N[C@H]2CCOc3c(C(=O)Nc4ccc(F)c(F)c4)cccc32)N1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 12/20 0.40
TP53 P04637 2/20 0.34
BRD4 O60885 2/20 0.33
CREBBP Q92793 2/20 0.33
MAOB P27338 1/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL21189255 1.00 TRPV1 (0.40) TRPV1TP53BRD4CREBBPMAOB
SCHEMBL21189428 0.86 CHRM3 (0.38) TRPV1TP53MAOBNPC1HPGD
SCHEMBL21189406 0.85 CHRM2 (0.41) TRPV1TP53
SCHEMBL21189326 0.84 NPC1 (0.45) TRPV1TP53MAOBNPC1HPGD
SCHEMBL21189486 0.84 NPC1 (0.45) TRPV1TP53MAOBNPC1HPGD
Hydrochloric Acid SCHEMBL19973591 0.84 CHRM2 (0.40) TRPV1TP53
SCHEMBL21189328 0.83 POLB (0.38) TRPV1TP53MAOBNPC1HPGD
SCHEMBL21189357 0.83 TP53 (0.38) TRPV1TP53MAOBNPC1HPGD
SCHEMBL21189519 0.83 TP53 (0.38) TRPV1TP53MAOBNPC1HPGD
SCHEMBL21189262 0.82 TP53 (0.42) TRPV1TP53MAOBNPC1HPGD

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 TRPV1 3647/4885TP53 166/4885BRD4 7/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS TRPV1 3647/4885TP53 166/4885BRD4 7/4885

“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.