SCHEMBL19868949

SCHEMBL19868949

COc1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 14/20 0.67
GCGR P47871 14/20 0.67
MAPK12 P53778 14/20 0.67
MAPK11 Q15759 14/20 0.67
MAPK14 Q16539 14/20 0.67
ALOX5 P09917 11/20 0.67
PRKD3 O94806 3/20 0.65
MAP4K4 O95819 3/20 0.65
FRK P42685 3/20 0.65
MAPK9 P45984 3/20 0.65
CSNK1A1 P48729 3/20 0.65
CSNK1D P48730 3/20 0.65
GSK3B P49841 3/20 0.65
CLK4 Q9HAZ1 3/20 0.65
PTK6 Q13882 2/20 0.65
PRKACA P17612 2/20 0.65
SLK Q9H2G2 2/20 0.65
KDM4E B2RXH2 1/20 0.65
CIT O14578 1/20 0.65
GAK O14976 1/20 0.65

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
SCHEMBL6449315 0.90 MAPK11 (0.72) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL6465326 0.86 MAPK13 (0.74) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL17002224 0.84 MAPK14 (0.67) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL8088592 0.83 NOX1 (0.81) KDM4EALDH1A1LMNACYP1A2CYP3A4
SCHEMBL19869002 0.83 ALOX5 (0.66) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL19868853 0.81 MAPK14 (0.74) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL17002179 0.81 MAPK14 (0.73) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL18960515 0.81 MAPK14 (0.67) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL2648503 0.81 MAPK11 (1.00) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL6452661 0.81 MAPK14 (0.76) MAPK13GCGRMAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180044316-A1 POTENTIATORS OF BETA-LACTAM ANTIBIOTICS UNIVERSITY OF NOTRE DAME DU LAC (US) 2018-02-15 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-20180044316-A1 POTENTIATORS OF BETA-LACTAM ANTIBIOTICS CREB1, PPP6R1, PPP1R10 MAPK13 782/4885GCGR 4261/4885MAPK12 363/4885

“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.