SCHEMBL21189350

SCHEMBL21189350

COC(=O)N[C@H]1CCOc2c(C(=O)Nc3cc(F)cc(F)c3)cccc21

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 10/20 0.38
PTGES O14684 2/20 0.38
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KMT2A Q03164 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPK1 P28482 1/20 0.35
APOB P04114 1/20 0.35
MTTP P55157 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP2D6 P10635 1/20 0.35
HSD17B2 P37059 1/20 0.35
BRD4 O60885 1/20 0.35

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
SCHEMBL21189267 0.91 AKR1C3 (0.38) TRPV1PTGESALDH1A1L3MBTL1NPC1
SCHEMBL21189281 0.91 LMNA (0.41) TRPV1ALDH1A1L3MBTL1KMT2ANPC1
SCHEMBL19973467 0.89 PTGES (0.39) TRPV1PTGESKMT2ANPC1RAB9A
SCHEMBL19973468 0.89 PTGES (0.39) TRPV1PTGESKMT2ANPC1RAB9A
SCHEMBL21189485 0.88 TP53 (0.42) TRPV1PTGESALDH1A1NPC1RAB9A
SCHEMBL21189206 0.88 TP53 (0.42) TRPV1PTGESALDH1A1NPC1RAB9A
SCHEMBL21189262 0.88 TP53 (0.42) TRPV1PTGESALDH1A1NPC1RAB9A
SCHEMBL21189407 0.87 CREBBP (0.42) ALDH1A1KMT2ANPC1RAB9AMAPK1
SCHEMBL21189284 0.86 APOB (0.42) TRPV1PTGESNPC1RAB9AAPOB
SCHEMBL21189278 0.85 FADS1 (0.46) PTGESALDH1A1KMT2ANPC1RAB9A

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 3647/4885PTGES 4518/4885ALDH1A1 3241/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS TRPV1 3647/4885PTGES 4518/4885ALDH1A1 3241/4885

“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.