SCHEMBL21189256

SCHEMBL21189256

Cc1cc(NC(=O)c2ccc(F)c3c2OCC[C@@H]3NC(=O)OCCc2ccccn2)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
NAAA Q02083 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
GRM4 Q14833 11/20 0.38
MTTP P55157 2/20 0.35
APOB P04114 1/20 0.35
SMO Q99835 1/20 0.35
GRK2 P25098 1/20 0.35
GRK5 P34947 1/20 0.35
ROCK1 Q13464 1/20 0.35
RECQL P46063 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
P2RX7 Q99572 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
SCHEMBL21189291 0.92 NPC1 (0.41) ALDH1A1NPC1RAB9AGRM4MTTP
SCHEMBL21189297 0.91 ALDH1A1 (0.44) ALDH1A1NAAAMEN1NPC1RAB9A
SCHEMBL19973485 0.89 ALDH1A1 (0.41) ALDH1A1GRM4MTTPAPOBSMO
SCHEMBL19973486 0.89 ALDH1A1 (0.41) ALDH1A1GRM4MTTPAPOBSMO
SCHEMBL21189277 0.87 GRM4 (0.37) GRM4P2RX7
SCHEMBL19973517 0.85 NPC1 (0.46) MEN1NPC1RAB9AKMT2AMTTP
SCHEMBL19973515 0.85 NPC1 (0.46) MEN1NPC1RAB9AKMT2AMTTP
SCHEMBL21189208 0.85 NPC1 (0.42) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL26714839 0.85 NPC1 (0.42) ALDH1A1NPC1RAB9AGRM4MTTP
SCHEMBL21189365 0.84 GRM4 (0.35) NPC1RAB9AGRM4SMN1; 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 ALDH1A1 3241/4885NAAA 653/4885MEN1 1933/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS ALDH1A1 3241/4885NAAA 653/4885MEN1 1933/4885

“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.