SCHEMBL19633119

SCHEMBL19633119

N=CN=C(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.40
TSHR P16473 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
NR1H2 P55055 1/20 0.37
BAX Q07812 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
HPGD P15428 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 2/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PRSS1 P07477 2/20 0.33
CA5A P35218 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
SCHEMBL12228517 0.72 LTA4H (0.41) LTA4HTSHRNR1H2BAXTDP1
SCHEMBL8411617 0.70 PRSS1 (0.40) LTA4HTSHRCA1CA2NR1H2
SCHEMBL8483797 0.70 CA4 (0.42) LTA4HTSHRNR1H2BAXTDP1
SCHEMBL22920659 0.68 TDP1 (0.47) LTA4HTSHRTDP1HPGDMAPT
SCHEMBL12782035 0.67 PRSS1 (0.45) LTA4HTSHRTDP1MAPTKDM4E
SCHEMBL2665439 0.66 LTA4H (0.45) LTA4HTSHRNR1H2BAXTDP1
SCHEMBL9748729 0.66 LTA4H (0.45) LTA4HTSHRNR1H2BAXTDP1
SCHEMBL9748734 0.66 LTA4H (0.45) LTA4HTSHRNR1H2BAXTDP1
SCHEMBL10253371 0.65 MAPT (0.36) LTA4HTSHRNR1H2BAXTDP1
SCHEMBL21842904 0.65 TDP1 (0.39) LTA4HTSHRNR1H2BAXTDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9994553-B2 Process for the purification of the Axl tyrosine receptor kinase inhibitor “R428” BERGENBIO AS (NO) 2018-06-12 US disclosed
US-9994553-B2 Process for the purification of the Axl tyrosine receptor kinase inhibitor “R428” BERGENBIO AS (NO) 2018-06-12 US disclosed
US-20170334884-A1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ BERGENBIO ASA (NO) 2017-11-23 US disclosed
US-20170334884-A1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ BERGENBIO ASA (NO) 2017-11-23 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 (1 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-20170334884-A1 PROCESS FOR THE PURIFICATION OF THE AXL TYROSINE RECEPTOR KINASE INHIBITOR \"R428\ AXL, TYRO3, RET LTA4H 4679/4885TSHR 121/4885CA1 2209/4885

“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.