SCHEMBL20183452

SCHEMBL20183452

CN(c1ncnc2[nH]ccc12)C1CCCNC1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 15/20 0.76
JAK1 P23458 15/20 0.76
JAK2 O60674 9/20 0.74
TYK2 P29597 3/20 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
SCHEMBL14615713 1.00 JAK3 (0.76) JAK3JAK1JAK2TYK2
SCHEMBL20183439 0.92 JAK1 (0.71) JAK3JAK1JAK2TYK2
SCHEMBL20183438 0.92 JAK1 (0.71) JAK3JAK1JAK2TYK2
SCHEMBL20183448 0.92 JAK1 (0.71) JAK3JAK1JAK2TYK2
SCHEMBL3534102 0.88 JAK3 (0.97) JAK3JAK1JAK2TYK2
SCHEMBL3534331 0.87 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3533457 0.85 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3542178 0.85 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3542483 0.85 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3541754 0.85 JAK3 (1.00) JAK3JAK1JAK2TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108137608-B Janus kinase 1 selective inhibitor and pharmaceutical application thereof 阳智化学(株) 2020-06-19 CN disclosed
CN-105712998-B Azaindole derivatives, preparation method and medical application thereof 上海润诺生物科技有限公司 2019-12-13 CN disclosed
US-10407430-B2 Janus kinase 1 selective inhibitor and pharmaceutical use thereof YANG JI CHEMICAL CO., LTD. (KR) 2019-09-10 US disclosed
US-20180237440-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF YANG JI CHEMICAL CO., LTD. (KR) 2018-08-23 US disclosed
EP-3327021-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF Yangji Chemical Co., Ltd. (KR) 2018-05-30 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 (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-10407430-B2 Janus kinase 1 selective inhibitor and pharmaceutical use thereof JAK1, JAK2, JAK3 JAK3 3/4885JAK1 1/4885JAK2 2/4885
US-20180237440-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF JAK1, JAK2, JAK3 JAK3 3/4885JAK1 1/4885JAK2 2/4885

“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.