SCHEMBL4302285

SCHEMBL4302285

CN(C(=O)O)C1CCN(c2nc(Nc3ccc(C(N)=O)cc3)ncc2F)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 11/20 0.57
LCK P06239 5/20 0.55
JAK2 O60674 3/20 0.51
AURKA O14965 2/20 0.51
AURKB Q96GD4 1/20 0.51
SYK P43405 3/20 0.49
JAK1 P23458 2/20 0.47
TYK2 P29597 2/20 0.47
KIT P10721 2/20 0.47
FLT3 P36888 2/20 0.47
KCNH2 Q12809 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL4303283 0.86 SYK (0.48) JAK3LCKJAK2SYKJAK1
SCHEMBL1018107 0.85 JAK3 (0.54) JAK3LCKJAK2AURKAAURKB
SCHEMBL1018051 0.84 JAK3 (0.52) JAK3LCKJAK2AURKAAURKB
SCHEMBL1018676 0.82 JAK3 (0.57) JAK3LCKJAK2AURKAAURKB
SCHEMBL4302281 0.81 JAK3 (0.53) JAK3LCKJAK2AURKAAURKB
SCHEMBL1018050 0.79 JAK3 (0.53) JAK3LCKJAK2AURKAAURKB
SCHEMBL4305668 0.79 ULK1 (0.55) SYK
SCHEMBL1018581 0.77 GSK3A (0.52) JAK3LCKJAK2AURKAAURKB
SCHEMBL12082586 0.76 JAK3 (0.51) JAK3LCKJAK2AURKAAURKB
SCHEMBL16209160 0.75 SMN1; SMN2 (0.54) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298823-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-03 US claimed
WO-2009131687-A2 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2009-10-29 WO claimed
EP-2271631-B1 INHIBITORS OF PROTEIN KINASES PORTOLA PHARM INC (US) 2018-07-04 EP disclosed
US-9139581-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2015-09-22 US disclosed
US-20130029944-A1 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2013-01-31 US disclosed
US-8258144-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-09-04 US disclosed
US-20090298823-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-03 US disclosed
WO-2009131687-A2 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2009-10-29 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 (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-20130029944-A1 INHIBITORS OF PROTEIN KINASES SYK, BTK, JAK2 JAK3 6/4885LCK 14/4885JAK2 3/4885
US-20090298823-A1 Inhibitors of protein kinases SYK, BTK, JAK2 JAK3 6/4885LCK 14/4885JAK2 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.