SCHEMBL10304562

SCHEMBL10304562

CC1CCCN1CC(C)(C)Nc1ccnc(-c2c[nH]c3ncc(Cl)cc23)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LATS1 O95835 1/20 0.41
▸ LATS2 Q9NRM7 1/20 0.41
▸ JAK3 P52333 1/20 0.39
▸ JAK2 O60674 1/20 0.37
▸ CDC7 O00311 1/20 0.37
▸ CHEK1 O14757 1/20 0.37
▸ MAPK13 O15264 1/20 0.37
▸ PDPK1 O15530 1/20 0.37
▸ DAPK3 O43293 1/20 0.37
▸ DYRK3 O43781 1/20 0.37
▸ PAK4 O96013 1/20 0.37
▸ CHEK2 O96017 1/20 0.37
▸ EGFR P00533 1/20 0.37
▸ PRKCG P05129 1/20 0.37
▸ CDK1 P06493 1/20 0.37
▸ LYN P07948 1/20 0.37
▸ ROS1 P08922 1/20 0.37
▸ FER P16591 1/20 0.37
▸ PRKACA P17612 1/20 0.37
▸ RPS6KB1 P23443 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
SCHEMBL10304534 0.86 JAK3 (0.42) JAK3JAK2MARK3TYK2PRKCD
SCHEMBL18051833 0.76 JAK2 (0.43) JAK3JAK2MARK3TYK2PRKCD
SCHEMBL18629277 0.76 PIM1 (0.46) —
SCHEMBL2633664 0.74 JAK2 (0.52) JAK3JAK2
SCHEMBL10304241 0.74 CDC7 (0.59) JAK3JAK2CDC7CHEK1MAPK13
SCHEMBL18629106 0.73 MAP3K11 (0.40) JAK3JAK2MARK3TYK2PRKCD
SCHEMBL2630222 0.73 ROCK2 (0.42) JAK3JAK2CDC7CHEK1MAPK13
SCHEMBL14712339 0.73 JAK2 (0.49) JAK3JAK2MARK3MAPK1TYK2
SCHEMBL18306275 0.73 MAP3K11 (0.40) JAK3JAK2MARK3TYK2PRKCD
SCHEMBL16015230 0.72 NTRK1 (0.43) JAK3JAK2MARK3TYK2PRKCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3141252-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION Vertex Pharmaceuticals Inc. (US) 2017-03-15 — — EP disclosed
EP-2442809-B1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION VERTEX PHARMA (US) 2016-08-31 — — EP disclosed
US-20120171245-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-05 — — 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 (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-20120171245-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION ACE, IRF3, ACE2 LATS1 3560/4885LATS2 3669/4885JAK3 878/4885

“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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