SCHEMBL21189300

SCHEMBL21189300

Cc1cc(NC(=O)c2ccc(F)c3c2OCC[C@@H]3NC(=O)OCCN2CCCC2=O)ccc1F

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 4/20 0.38
POLB P06746 1/20 0.37
MEN1 O00255 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 1/20 0.35
EPHX2 P34913 3/20 0.35
DRD4 P21917 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
AVPR2 P30518 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 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
SCHEMBL21189193 0.91 MEN1 (0.47) SMN1; SMN2LMNAKMT2APOLBMEN1
SCHEMBL21189312 0.84 DRD4 (0.33) SMN1; SMN2LMNAKMT2APOLBMEN1
SCHEMBL21189314 0.84 DRD4 (0.33) SMN1; SMN2LMNAKMT2APOLBMEN1
SCHEMBL21189302 0.83 NPC1 (0.36) RAB9ADRD4TMEM97SIGMAR1AVPR2
SCHEMBL21189433 0.82 APOB (0.40) SMN1; SMN2RAB9ADRD4TMEM97SIGMAR1
SCHEMBL21189248 0.82 APOB (0.40) SMN1; SMN2RAB9ADRD4TMEM97SIGMAR1
SCHEMBL21189362 0.81 IRAK4 (0.35) LMNARAB9ADRD4TMEM97SIGMAR1
SCHEMBL21189298 0.80 IRAK4 (0.35) RAB9ADRD4TMEM97SIGMAR1
SCHEMBL21189295 0.80 IRAK4 (0.35) RAB9ADRD4TMEM97SIGMAR1
SCHEMBL21189301 0.80 GRM4 (0.34) CYP3A4RAB9ADRD4TMEM97SIGMAR1

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 SMN1; SMN2 3837/4885LMNA 477/4885KMT2A 155/4885
US-11001564-B2 Substituted chromane-8-carboxamide compounds and analogues thereof, and methods using same CBX8, HAVCR2, HCCS SMN1; SMN2 3837/4885LMNA 477/4885KMT2A 155/4885

“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.