SCHEMBL21189427

SCHEMBL21189427

O=C(N[C@H]1CCOc2c(C(=O)Nc3ccc(F)c(F)c3)cccc21)OCc1cc(Cl)ccn1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 1/20 0.39
P2RX7 Q99572 9/20 0.39
GRM4 Q14833 4/20 0.38
EGFR P00533 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PTGES O14684 3/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL21189264 0.91 NPC1 (0.44) NPC1RAB9AMAPTP2RX7GRM4
SCHEMBL21189330 0.91 NPC1 (0.44) NPC1RAB9AMAPTP2RX7GRM4
SCHEMBL19973466 0.91 NPC1 (0.44) NPC1RAB9AMAPTP2RX7GRM4
SCHEMBL21189187 0.90 RAB9A (0.37) NPC1RAB9AMAPTP2RX7GRM4
SCHEMBL21189294 0.89 PTGES (0.37) NPC1RAB9AMAPTP2RX7GRM4
SCHEMBL21189272 0.89 GRM4 (0.36) NPC1RAB9AMAPTP2RX7GRM4
SCHEMBL21189337 0.88 P2RX7 (0.39) P2RX7GRM4PTGES
SCHEMBL21189250 0.88 GRM4 (0.36) NPC1RAB9AMAPTP2RX7GRM4
SCHEMBL21189252 0.88 TRPV1 (0.36) NPC1RAB9AP2RX7ALDH1A1PTGES
SCHEMBL21189254 0.87 P2RX7 (0.44) P2RX7GRM4ALDH1A1PTGES

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 NPC1 983/4885RAB9A 1393/4885MAPT 3165/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS NPC1 983/4885RAB9A 1393/4885MAPT 3165/4885

“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.