SCHEMBL18996751

SCHEMBL18996751

Cc1ncc(-c2cn3ccnc3c(Nc3ccc(N4CCN(C5CCC5)CC4)cc3)n2)nc1N

nearest known ligand 0.83

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.83
▸ CD63 P08962 6/20 0.83
▸ JAK2 O60674 1/20 0.63

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
SCHEMBL16820575 0.91 SYK (1.00) SYKCD63JAK2
SCHEMBL18996752 0.86 SYK (0.83) SYKCD63JAK2
SCHEMBL18996757 0.83 SYK (0.86) SYKCD63JAK2
SCHEMBL16820596 0.79 SYK (0.78) SYKCD63JAK2
SCHEMBL16820600 0.79 SYK (0.78) SYKCD63JAK2
Hydrochloric Acid SCHEMBL30850383 0.79 SYK (0.78) SYKCD63JAK2
Lanraplenib SCHEMBL29422916 0.77 SYK (1.00) SYKCD63JAK2
Lanraplenib SCHEMBL16820581 0.77 SYK (1.00) SYKCD63JAK2
SCHEMBL16848702 0.77 SYK (0.81) SYKCD63JAK2
SCHEMBL23470341 0.77 SYK (0.86) SYKCD63JAK2

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-20170173034-A1 COMBINATION OF A JAK INHIBITOR AND A SYK INHIBITOR FOR TREATING CANCERS AND INFLAMMATORY DISORDERS GILEAD SCIENCES, INC. 2017-06-22 — — 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-20170173034-A1 COMBINATION OF A JAK INHIBITOR AND A SYK INHIBITOR FOR TREATING CANCERS AND INFLAMMATORY DISORDERS SYK, BTK, JAK1 SYK 1/4885CD63 2662/4885JAK2 4/4885

“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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