SCHEMBL20066406

SCHEMBL20066406

CB(O)NC/C=C/Cn1c(N)nc2cc(C(N)=O)ccc21

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.47
▸ JAK2 O60674 18/20 0.42
▸ JAK1 P23458 18/20 0.42
▸ TYK2 P29597 18/20 0.42
▸ JAK3 P52333 18/20 0.42
▸ PTGER4 P35408 1/20 0.39

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
SCHEMBL22121416 0.86 KMT2A (0.57) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL19436567 0.84 KMT2A (0.50) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL19436528 0.84 KMT2A (0.50) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL22151665 0.82 KDM4E (0.55) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL28421225 0.80 STING1 (0.48) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL19451470 0.80 STING1 (0.48) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL29405998 0.80 STING1 (0.48) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL22121411 0.78 KMT2A (0.52) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL22121391 0.77 KDM4E (0.60) KMT2APTGER4
SCHEMBL19436552 0.77 PTGER4 (0.56) KMT2AJAK2JAK1TYK2JAK3

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-20180105514-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-04-19 — — 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-20180105514-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS RB1, RBBP5, RCC2 KMT2A 1428/4885JAK2 2724/4885JAK1 2260/4885

“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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