SCHEMBL21189365

SCHEMBL21189365

Cc1cc(NC(=O)c2ccc(F)c3c2OCC[C@@H]3NC(=O)OCc2cnccn2)ccc1F

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 13/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPK1 P28482 1/20 0.34
MLLT1 Q03111 1/20 0.34
DRD4 P21917 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FGFR3 P22607 1/20 0.33
CYP1A2 P05177 1/20 0.33
NLRP3 Q96P20 1/20 0.33

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 0.90 NPC1 (0.41) GRM4NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL21189359 0.89 GRM4 (0.36) GRM4MLLT1DRD4TMEM97SIGMAR1
SCHEMBL21189277 0.88 GRM4 (0.37) GRM4DRD4TMEM97SIGMAR1
SCHEMBL21189256 0.84 ALDH1A1 (0.39) GRM4NPC1RAB9ASMN1; SMN2
SCHEMBL21189208 0.83 NPC1 (0.42) GRM4NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL21189433 0.83 APOB (0.40) NPC1RAB9ADRD4TMEM97SIGMAR1
SCHEMBL21189248 0.83 APOB (0.40) NPC1RAB9ADRD4TMEM97SIGMAR1
SCHEMBL21189272 0.82 GRM4 (0.36) GRM4NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL26714839 0.82 NPC1 (0.42) GRM4NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL21189292 0.81 NPC1 (0.45) GRM4NPC1RAB9AMAPTSMN1; 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 GRM4 3439/4885NPC1 983/4885RAB9A 1393/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS GRM4 3439/4885NPC1 983/4885RAB9A 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.