SCHEMBL7843492

SCHEMBL7843492

CN(c1ncnc2[nH]ccc12)C1CCCC1.NCC1CCCC1

nearest known ligand 0.83

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 16/20 0.83
JAK1 P23458 15/20 0.83
JAK2 O60674 11/20 0.81
TYK2 P29597 6/20 0.65

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
SCHEMBL7853331 0.99 JAK3 (0.83) JAK3JAK1JAK2TYK2
SCHEMBL7850267 0.99 JAK3 (0.83) JAK3JAK1JAK2TYK2
SCHEMBL7088978 0.99 JAK1 (0.81) JAK3JAK1JAK2TYK2
SCHEMBL3534331 0.91 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3542178 0.90 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3542483 0.90 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3541754 0.90 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3533457 0.90 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3535221 0.90 JAK3 (1.00) JAK3JAK1JAK2TYK2
SCHEMBL3534102 0.90 JAK3 (0.97) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1087970-A1 PYRROLO 2,3-d]PYRIMIDINE COMPOUNDS Pfizer Products Inc. (US) 2001-04-04 EP disclosed
WO-1999065908-A1 PYRROLO[2,3-d]PYRIMIDINE COMPOUNDS PFIZER PRODUCTS INC. (US) 1999-12-23 WO disclosed