SCHEMBL7843466

SCHEMBL7843466

CNC1CCCCC1.Cc1cc2c(NCC3CCCCC3)ncnc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.46
JAK1 P23458 2/20 0.46
CSF1R P07333 5/20 0.45
EGFR P00533 1/20 0.40
CLK1 P49759 1/20 0.40
CLK2 P49760 1/20 0.40
CLK3 P49761 1/20 0.40
DYRK1A Q13627 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
UTS2R Q9UKP6 1/20 0.38
PTK2 Q05397 1/20 0.38
KIT P10721 2/20 0.36
CHRM4 P08173 1/20 0.36
APP P05067 1/20 0.36
AURKA O14965 1/20 0.36
RPS6KB1 P23443 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GRM4 Q14833 1/20 0.36

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
SCHEMBL3532802 0.93 CSF1R (0.50) JAK2JAK1CSF1REGFRCLK1
SCHEMBL7850698 0.83 CSF1R (0.69) JAK2JAK1CSF1REGFR
SCHEMBL7850265 0.80 JAK1 (0.62) JAK2JAK1
SCHEMBL7853326 0.80 JAK1 (0.62) JAK2JAK1
SCHEMBL7843489 0.79 JAK1 (0.63) JAK2JAK1
SCHEMBL3536147 0.79 EGFR (0.58) JAK2JAK1CSF1REGFR
SCHEMBL7088975 0.76 JAK1 (0.60) JAK2JAK1
SCHEMBL3542880 0.73 CSF1R (0.79) JAK2JAK1CSF1REGFRUTS2R
SCHEMBL3542175 0.70 JAK1 (0.68) JAK2JAK1
SCHEMBL3542480 0.70 JAK1 (0.68) JAK2JAK1

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 4 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
EP-1087971-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
WO-1999065909-A1 PYRROLO[2,3-d]PYRIMIDINE COMPOUNDS PFIZER PRODUCTS INC. (US) 1999-12-23 WO disclosed