SCHEMBL21189313

SCHEMBL21189313

O=C(Nc1ccc(F)c(F)c1)c1ccc(F)c2c1OCCC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.49
TP53 P04637 3/20 0.48
RAB9A P51151 11/20 0.46
NPC1 O15118 9/20 0.46
LMNA P02545 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
HPGD P15428 1/20 0.43
ENPP2 Q13822 1/20 0.43
MAPT P10636 3/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NFKB1 P19838 1/20 0.41
HTT P42858 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41

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
SCHEMBL21189388 0.90 NPC1 (0.44) MAOBTP53RAB9ANPC1LMNA
SCHEMBL19973431 0.79 MAOB (0.48) MAOBTP53RAB9ANPC1LMNA
SCHEMBL15786679 0.79 RAB9A (0.54) MAOBTP53RAB9ANPC1LMNA
SCHEMBL19973903 0.77 TP53 (0.54) MAOBTP53RAB9ANPC1LMNA
SCHEMBL15786668 0.76 NPC1 (0.60) MAOBTP53RAB9ANPC1LMNA
SCHEMBL19973436 0.75 NPC1 (0.49) MAOBTP53RAB9ANPC1LMNA
Hydrochloric Acid SCHEMBL19973572 0.74 MAOB (0.46) MAOBTP53RAB9ANPC1LMNA
Hydrochloric Acid SCHEMBL19974001 0.74 MAOB (0.46) MAOBTP53RAB9ANPC1LMNA
SCHEMBL19973510 0.73 MAOB (0.45) MAOBTP53RAB9ANPC1LMNA
SCHEMBL21189280 0.73 FADS1 (0.54) TP53RAB9ANPC1LMNAALDH1A1

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 MAOB 1792/4885TP53 166/4885RAB9A 1393/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS MAOB 1792/4885TP53 166/4885RAB9A 1393/4885

“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.