SCHEMBL17661758

SCHEMBL17661758

COc1nc(N)cc(Oc2cccc(-c3nnc(Nc4cccc(C(F)(F)F)c4)o3)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ GSK3B P49841 2/20 0.46
▸ KDM4E B2RXH2 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ PDGFRB P09619 1/20 0.42
▸ KIT P10721 1/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ CDK11B P21127 1/20 0.42
▸ FLT3 P36888 1/20 0.42
▸ CDKL2 Q92772 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41

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
SCHEMBL14949499 0.89 PDGFRB (0.44) GSK3BKDM4ENPC1HPGDRAB9A
SCHEMBL12336259 0.89 GSK3B (0.45) LMNAMAPTGSK3BKDM4ENPC1
SCHEMBL17658729 0.88 KDM4E (0.42) MAPTMAPK1GSK3BKDM4ENPC1
SCHEMBL16789109 0.88 SMN1; SMN2 (0.48) LMNAMAPTMAPK1GSK3BKDM4E
SCHEMBL12336273 0.87 PDGFRB (0.57) GSK3BKDM4ENPC1HPGDRAB9A
SCHEMBL17662111 0.85 GSK3B (0.43) LMNAMAPTGSK3BKDM4ENPC1
SCHEMBL16789108 0.83 KDR (0.53) GSK3BKDM4ENPC1HPGDRAB9A
SCHEMBL627855 0.81 GSK3B (0.51) LMNAMAPTGSK3BKDM4EPDGFRB
SCHEMBL12336434 0.81 KDR (0.47) MAPTGSK3BKDM4ENPC1HPGD
SCHEMBL12336580 0.81 MAPT (0.47) LMNAMAPTMAPK1KDM4EPDGFRB

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-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-04-07 — — 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-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 LMNA 3696/4885MAPT 4114/4885MAPK1 109/4885

“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.

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