SCHEMBL21189272

SCHEMBL21189272

O=C(N[C@H]1CCOc2c(C(=O)Nc3ccc(F)c(F)c3)cccc21)OCc1cnccn1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 6/20 0.36
P2RX7 Q99572 4/20 0.35
LRRK2 Q5S007 1/20 0.35
SGMS2 Q8NHU3 1/20 0.35
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 2/20 0.34
MAPT P10636 2/20 0.34
RAB9A P51151 2/20 0.34
TP53 P04637 1/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TRPV1 Q8NER1 2/20 0.34

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
SCHEMBL21189491 0.93 L3MBTL1 (0.40) GRM4P2RX7SGMS2NPC1MAPT
SCHEMBL19973466 0.91 NPC1 (0.44) GRM4P2RX7SMN1; SMN2NPC1MAPT
SCHEMBL21189330 0.91 NPC1 (0.44) GRM4P2RX7SMN1; SMN2NPC1MAPT
SCHEMBL21189264 0.91 NPC1 (0.44) GRM4P2RX7SMN1; SMN2NPC1MAPT
SCHEMBL21189250 0.89 GRM4 (0.36) GRM4P2RX7NPC1MAPTRAB9A
SCHEMBL21189427 0.89 NPC1 (0.39) GRM4P2RX7SMN1; SMN2NPC1MAPT
SCHEMBL21189487 0.88 MEN1 (0.42) GRM4P2RX7LRRK2SGMS2CYP11B1
SCHEMBL21189329 0.88 MEN1 (0.42) GRM4P2RX7LRRK2SGMS2CYP11B1
SCHEMBL21189337 0.88 P2RX7 (0.39) GRM4P2RX7TP53KMT2ATRPV1
SCHEMBL21189263 0.87 NAMPT (0.39) GRM4P2RX7SMN1; SMN2NPC1RAB9A

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 GRM4 3439/4885P2RX7 676/4885LRRK2 3182/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS GRM4 3439/4885P2RX7 676/4885LRRK2 3182/4885

“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.