SCHEMBL20053355

SCHEMBL20053355

CCC(C)c1ncnc2scnc12

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.46
PI4K2B Q8TCG2 1/20 0.46
PI4K2A Q9BTU6 1/20 0.46
PI4KB Q9UBF8 1/20 0.46

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
SCHEMBL4569212 0.82 PI4KA (0.52) PI4KAPI4K2BPI4K2API4KB
SCHEMBL20827673 0.79 PI4KA (0.42) PI4KAPI4K2BPI4K2API4KB
SCHEMBL20827784 0.78 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KB
SCHEMBL20827732 0.76 PI4KA (0.40) PI4KAPI4K2BPI4K2API4KB
SCHEMBL19185300 0.74 PI4KA (0.38) PI4KAPI4K2BPI4K2API4KB
SCHEMBL20782409 0.73 PI4KA (0.40) PI4KAPI4K2BPI4K2API4KB
SCHEMBL20827757 0.73 PI4KA (0.40) PI4KAPI4K2BPI4K2API4KB
SCHEMBL20072408 0.71 CHEK1 (0.47)
SCHEMBL21388659 0.71 PI4KA (0.52) PI4KAPI4K2BPI4K2API4KB
SCHEMBL14024537 0.68 KDM4E (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10259818-B2 Bicyclic azaheterocyclobenzylamines as PI3K inhibitors INCYTE CORPORATION (US) 2019-04-16 US disclosed
US-9944646-B2 Bicyclic azaheterocyclobenzylamines as PI3K inhibitors INCYTE HOLDINGS CORPORATION (US) 2018-04-17 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-10259818-B2 Bicyclic azaheterocyclobenzylamines as PI3K inhibitors PIK3CD, PIK3CA, PIK3CB PI4KA 10/4885PI4K2B 14/4885PI4K2A 20/4885

“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.