SCHEMBL21189294

SCHEMBL21189294

O=C(N[C@H]1CCOc2c(C(=O)Nc3ccc(F)c(F)c3)cccc21)OCc1ccc(Cl)cn1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGES O14684 4/20 0.37
P2RX7 Q99572 5/20 0.37
GRM4 Q14833 2/20 0.36
BACE1 P56817 3/20 0.36
BACE2 Q9Y5Z0 2/20 0.36
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 1/20 0.35
EGFR P00533 1/20 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
SCHEMBL21189189 0.90 MEN1 (0.38) BACE1BACE2NPC1RAB9ASMN1; SMN2
SCHEMBL21189427 0.89 NPC1 (0.39) PTGESP2RX7GRM4NPC1RAB9A
SCHEMBL19973466 0.89 NPC1 (0.44) P2RX7GRM4NPC1RAB9ASMN1; SMN2
SCHEMBL21189264 0.89 NPC1 (0.44) P2RX7GRM4NPC1RAB9ASMN1; SMN2
SCHEMBL21189330 0.89 NPC1 (0.44) P2RX7GRM4NPC1RAB9ASMN1; SMN2
SCHEMBL21189272 0.88 GRM4 (0.36) P2RX7GRM4NPC1RAB9ASMN1; SMN2
SCHEMBL21189250 0.88 GRM4 (0.36) PTGESP2RX7GRM4NPC1RAB9A
SCHEMBL21189337 0.86 P2RX7 (0.39) PTGESP2RX7GRM4
SCHEMBL21189252 0.86 TRPV1 (0.36) PTGESP2RX7NPC1RAB9ASMN1; SMN2
SCHEMBL21189289 0.85 NPC1 (0.46) P2RX7GRM4NPC1RAB9ASMN1; SMN2

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 PTGES 4518/4885P2RX7 676/4885GRM4 3439/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS PTGES 4518/4885P2RX7 676/4885GRM4 3439/4885

“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.