SCHEMBL4934221

SCHEMBL4934221

CC1(C)Oc2cc(Nc3nc(Nc4cccc(S(N)(=O)=O)c4)ncc3F)cnc2NC1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 9/20 0.64
▸ JAK3 P52333 9/20 0.64
▸ SYK P43405 8/20 0.55
▸ ADORA3 P0DMS8 2/20 0.53
▸ TYRO3 Q06418 2/20 0.53
▸ CDK2 P24941 5/20 0.51
▸ CCNE2 O96020 3/20 0.51
▸ CCNE1 P24864 3/20 0.51
▸ CDK1 P06493 4/20 0.49
▸ CDK7 P50613 3/20 0.49
▸ CDK5 Q00535 2/20 0.49
▸ JAK2 O60674 2/20 0.49
▸ EGFR P00533 2/20 0.49
▸ LCK P06239 2/20 0.49
▸ LYN P07948 2/20 0.49
▸ FGFR4 P22455 2/20 0.49
▸ BMPR1B O00238 1/20 0.49
▸ CDC7 O00311 1/20 0.49
▸ PIK3CD O00329 1/20 0.49
▸ PLK4 O00444 1/20 0.49

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
SCHEMBL4138063 0.87 SYK (0.55) JAK1JAK3SYKADORA3TYRO3
SCHEMBL4005818 0.81 JAK3 (0.71) JAK1JAK3SYKCDK2CCNE2
SCHEMBL17669875 0.80 JAK1 (0.59) JAK1JAK3SYKCDK2CCNE2
SCHEMBL4258546 0.78 JAK3 (0.84) JAK1JAK3SYKTYRO3CDK2
SCHEMBL1476669 0.78 JAK3 (1.00) JAK1JAK3SYKCDK2CDK1
SCHEMBL13166449 0.77 SYK (0.77) JAK1JAK3SYKCDK2CCNE2
SCHEMBL4128544 0.76 JAK1 (0.63) JAK1JAK3SYKCDK2CCNE2
SCHEMBL4146597 0.76 BRD4 (0.53) JAK1JAK3SYKADORA3TYRO3
SCHEMBL3996126 0.76 AURKA (0.67) JAK1JAK3SYKCDK2CCNE2
SCHEMBL4356714 0.76 SYK (0.43) JAK1JAK3SYKADORA3TYRO3

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-20080306099-A1 Prevent transplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-12-11 — — US claimed

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-20080306099-A1 Prevent transplant rejection; autoimmune diseases JAK3, JAK1, JAK2 JAK1 2/4885JAK3 1/4885SYK 268/4885

“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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