SCHEMBL18878981

SCHEMBL18878981

CNc1noc2ccncc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.54
LATS1 O95835 1/20 0.38
LATS2 Q9NRM7 1/20 0.38
AOC1 P19801 2/20 0.33
AOC3 Q16853 2/20 0.33
FAAH O00519 1/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
KCNA5 P22460 1/20 0.33
HIF1A Q16665 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
ALOX15 P16050 1/20 0.31
EP300 Q09472 1/20 0.31
KAT2B Q92831 1/20 0.31
KAT8 Q9H7Z6 1/20 0.31

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
SCHEMBL18878978 0.85 EPHX2 (0.54) EPHX2LATS1LATS2AOC1AOC3
SCHEMBL30298447 0.75 EPHX2 (0.54) EPHX2KCNA5
SCHEMBL10293735 0.75 EPHX2 (0.43) EPHX2CYP1A2CYP3A4HSD17B10CYP2D6
SCHEMBL11450556 0.75 EPHX2 (0.54) EPHX2KCNA5
SCHEMBL1720968 0.73 EPHX2 (0.46) EPHX2CYP1A2CYP3A4HSD17B10CYP2D6
SCHEMBL1720360 0.72 EPHX2 (0.45) EPHX2LATS1LATS2
SCHEMBL2773548 0.71 EPHX2 (0.43) EPHX2HIF1AEP300KAT2BKAT8
SCHEMBL1724416 0.71 EPHX2 (0.43) EPHX2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL30537240 0.71 EPHX2 (0.43) EPHX2HIF1AEP300KAT2BKAT8
SCHEMBL18697150 0.70 MAPT (0.47) EPHX2

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-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS EFFECTOR THERAPEUTICS, INC. 2017-05-25 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 (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-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS MAP3K9, MAP3K19, MAP3K20 EPHX2 3362/4885LATS1 897/4885LATS2 884/4885

“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.