SCHEMBL19631352

SCHEMBL19631352

CC(C)c1cnc2[nH]cc(C(C)C(C)C)c2n1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.33
JAK1 P23458 3/20 0.33
JAK3 P52333 3/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL19155416 0.88 MAPK1 (0.35) JAK2JAK1JAK3MAPK1
SCHEMBL24025969 0.75 JAK2 (0.35) JAK2JAK1JAK3MAPK1
SCHEMBL25718741 0.75 IRAK4 (0.33)
SCHEMBL18352331 0.74 JAK2 (0.34) JAK2JAK1JAK3MAPK1
SCHEMBL14795128 0.72 JAK2 (0.46) JAK2JAK1JAK3
SCHEMBL16797942 0.71 JAK2 (0.45) JAK2JAK1JAK3
SCHEMBL25099112 0.71 MAPK1 (0.30) JAK2JAK1JAK3MAPK1
SCHEMBL650183 0.69 JAK3 (0.65) JAK2JAK1JAK3
SCHEMBL2325947 0.66 JAK3 (0.44) JAK2JAK1JAK3
SCHEMBL18720827 0.65 JAK3 (0.42) JAK2JAK1JAK3

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-10246466-B2 Diaryl macrocycles as modulators of protein kinases TP THERAPEUTICS, INC. (US) 2019-04-02 US disclosed
US-20170334929-A1 DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES Turning Point Therapeutics, Inc. 2017-11-23 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 (2 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-20170334929-A1 DIARYL MACROCYCLES AS MODULATORS OF PROTEIN KINASES MAP3K20, LCK, MAP3K1 JAK2 60/4885JAK1 228/4885JAK3 295/4885
US-10246466-B2 Diaryl macrocycles as modulators of protein kinases MAP3K20, LCK, MAP3K1 JAK2 60/4885JAK1 228/4885JAK3 295/4885

“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.