SCHEMBL23879028

SCHEMBL23879028

O=C(O)N1C2CCC1CC(Nc1nc(Nc3cc(CO)[nH]n3)c3ccsc3n1)C2

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 12/20 0.47
▸ JAK2 O60674 6/20 0.39
▸ TYK2 P29597 4/20 0.39
▸ JAK3 P52333 4/20 0.39
▸ BRD4 O60885 6/20 0.38
▸ BRD2 P25440 1/20 0.38
▸ BRD3 Q15059 1/20 0.38
▸ NTRK1 P04629 1/20 0.37

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
SCHEMBL23878876 0.90 JAK2 (0.46) JAK1JAK2TYK2JAK3BRD4
SCHEMBL30147222 0.88 JAK1 (0.47) JAK1JAK2TYK2JAK3BRD4
SCHEMBL22054226 0.88 JAK1 (0.47) JAK1JAK2TYK2JAK3BRD4
SCHEMBL23889629 0.88 JAK1 (0.47) JAK1JAK2TYK2JAK3BRD4
SCHEMBL24995537 0.88 JAK1 (0.42) JAK1JAK2BRD4BRD2BRD3
SCHEMBL23879004 0.87 TYK2 (0.47) JAK1JAK2TYK2JAK3BRD4
SCHEMBL22054227 0.84 JAK1 (0.52) JAK1JAK2TYK2JAK3BRD4
SCHEMBL23879051 0.84 JAK1 (0.52) JAK1JAK2TYK2JAK3BRD4
SCHEMBL30147204 0.83 TYK2 (0.48) JAK1JAK2TYK2JAK3BRD4
SCHEMBL22054611 0.81 TYK2 (0.46) JAK1JAK2TYK2JAK3BRD4

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-20230043863-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2023-02-09 — — US disclosed
EP-3889152-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2021-10-06 — — EP 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-20230043863-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF WEE2, WEE1, RORB JAK1 12/4885JAK2 19/4885TYK2 105/4885

“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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