SCHEMBL21189409

SCHEMBL21189409

COC(=O)N[C@H]1CCOc2c(C(=O)Nc3ccc(F)c(F)c3)ccc(Cl)c21

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.43
RAB9A P51151 7/20 0.43
MAPT P10636 2/20 0.43
ENPP2 Q13822 1/20 0.43
MAOB P27338 2/20 0.39
CPT2 P23786 1/20 0.38
CPT1A P50416 1/20 0.38
CPT1B Q92523 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
PTGES O14684 1/20 0.38

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
SCHEMBL21189527 0.92 MAOB (0.42) NPC1RAB9AMAPTENPP2MAOB
SCHEMBL21189392 0.92 MAOB (0.42) NPC1RAB9AMAPTENPP2MAOB
SCHEMBL21189343 0.92 MAOB (0.42) NPC1RAB9AMAPTENPP2MAOB
SCHEMBL21189195 0.90 NPC1 (0.46) NPC1RAB9AMAPTCPT2CPT1A
SCHEMBL21189275 0.90 NPC1 (0.46) NPC1RAB9AMAPTCPT2CPT1A
SCHEMBL21189276 0.90 NPC1 (0.46) NPC1RAB9AMAPTCPT2CPT1A
SCHEMBL19973475 0.89 NPC1 (0.45) NPC1RAB9AENPP2MAOBLMNA
SCHEMBL19973474 0.89 NPC1 (0.45) NPC1RAB9AENPP2MAOBLMNA
SCHEMBL19973414 0.89 NPC1 (0.43) NPC1RAB9AMAPTENPP2MAOB
SCHEMBL19973415 0.89 NPC1 (0.43) NPC1RAB9AMAPTENPP2MAOB

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.