SCHEMBL21455030

SCHEMBL21455030

COc1cc(Nc2ncc(C(N)=O)c(NC3CC3)n2)ccc1N1CCNCC1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SYK P43405 20/20 0.70
JAK2 O60674 1/20 0.57
JAK1 P23458 1/20 0.57
JAK3 P52333 1/20 0.57

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
SCHEMBL21455023 0.88 SYK (0.65) SYKJAK2JAK1JAK3
SCHEMBL21455274 0.88 SYK (0.67) SYKJAK2JAK1JAK3
SCHEMBL21455069 0.88 SYK (0.73) SYKJAK2JAK1JAK3
SCHEMBL17076538 0.87 SYK (0.73) SYK
SCHEMBL21455068 0.87 SYK (0.73) SYKJAK2JAK1JAK3
SCHEMBL21455059 0.87 SYK (0.66) SYKJAK2JAK1JAK3
SCHEMBL17076580 0.87 SYK (0.73) SYKJAK2JAK1JAK3
SCHEMBL21455065 0.86 SYK (0.61) SYKJAK2JAK1JAK3
SCHEMBL21455067 0.86 SYK (0.61) SYKJAK2JAK1JAK3
SCHEMBL764498 0.85 SYK (0.71) SYK

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-10730887-B2 Compound containing tricyclic heteroaryl group HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2020-08-04 US disclosed
US-20190308993-A1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP HANGZHOU INNOGATE PHARMA CO., LTD. (CN) 2019-10-10 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-20190308993-A1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP JAK3, ERBB3, CDK3 SYK 6/4885JAK2 9/4885JAK1 7/4885
US-10730887-B2 Compound containing tricyclic heteroaryl group JAK3, ERBB3, CDK3 SYK 6/4885JAK2 9/4885JAK1 7/4885

“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.