SCHEMBL1160281

SCHEMBL1160281

N#Cc1cnn2cccc2c1NC1CCCC1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 14/20 0.64
TYK2 P29597 13/20 0.64
JAK3 P52333 12/20 0.60
JAK2 O60674 11/20 0.60
CDK2 P24941 1/20 0.39
CSNK2A1 P68400 1/20 0.39
CTSK P43235 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.38
EPHB3 P54753 1/20 0.38

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
SCHEMBL1160492 0.99 JAK1 (0.63) JAK1TYK2JAK3JAK2CDK2
SCHEMBL1160503 0.99 JAK1 (0.63) JAK1TYK2JAK3JAK2CDK2
SCHEMBL1160314 0.88 JAK1 (0.61) JAK1TYK2JAK3JAK2CDK2
SCHEMBL1160504 0.88 JAK1 (0.64) JAK1TYK2JAK3JAK2CSNK2A1
SCHEMBL1160338 0.87 JAK1 (0.54) JAK1TYK2JAK3JAK2IRAK4
SCHEMBL1160605 0.87 JAK1 (0.54) JAK1TYK2JAK3JAK2
SCHEMBL9923428 0.86 JAK1 (0.53) JAK1TYK2JAK3JAK2CDK2
SCHEMBL12875537 0.84 JAK1 (0.51) JAK1TYK2JAK3JAK2IRAK4
SCHEMBL1160181 0.84 JAK1 (0.53) JAK1TYK2JAK3JAK2
SCHEMBL1160418 0.84 JAK1 (0.56) JAK1TYK2JAK3JAK2CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 US claimed
EP-2459562-A1 PYRROLO [1, 2-B]PYRIDAZINE DERIVATIVES AS JANUS KINASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-06 EP claimed
WO-2011014817-A1 PYRROLO [1, 2-B] PYRIDAZINE DERIVATIVES AS JANUS KINASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-02-03 WO claimed
CN-102596959-A Pyrrolo [1,2-B ] pyridazine derivatives as JANUS kinase inhibitors BIOCRYST PHARM INC 2012-07-18 CN disclosed
US-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
EP-2459562-A1 PYRROLO [1, 2-B]PYRIDAZINE DERIVATIVES AS JANUS KINASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-06 EP disclosed
WO-2011014817-A1 PYRROLO [1, 2-B] PYRIDAZINE DERIVATIVES AS JANUS KINASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-02-03 WO disclosed
WO-2011014817-A1 PYRROLO [1, 2-B] PYRIDAZINE DERIVATIVES AS JANUS KINASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-02-03 WO 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-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors JAK1, JAK2, JAK3 JAK1 1/4885TYK2 10/4885JAK3 3/4885

“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.