SCHEMBL5707366

SCHEMBL5707366

CCOc1cc2cc(C(N)=O)cnc2cc1OCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 3/20 0.54
TSHR P16473 2/20 0.51
MAPK1 P28482 1/20 0.47
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
PDGFRB P09619 2/20 0.45
PDGFRA P16234 2/20 0.45
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
PARP10 Q53GL7 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
BPTF Q12830 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
CYP3A4 P08684 1/20 0.39
CHEK2 O96017 1/20 0.39

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
SCHEMBL6061808 0.89 HPGDS (0.49) HPGDSTSHRMAPK1LMNAHTT
SCHEMBL17967327 0.84 HPGDS (0.64) HPGDSPDGFRBPDGFRAKDM4EALDH1A1
SCHEMBL30012192 0.80 CSF1R (0.54) HPGDSTSHRMEN1KMT2AKDM4E
SCHEMBL27765442 0.79 HPGDS (0.74) HPGDSPARP10CHEK2
SCHEMBL20799516 0.78 HPGDS (0.59) HPGDSPDGFRBPDGFRAKDM4EALDH1A1
SCHEMBL19020876 0.77 HPGDS (0.46) HPGDSTSHRPDGFRBPDGFRA
SCHEMBL3873425 0.77 HPGDS (0.58) HPGDSPDGFRBPDGFRAKDM4EALDH1A1
SCHEMBL19021397 0.77 MGAM (0.45) HPGDSTSHRHTTPDGFRBPDGFRA
SCHEMBL18988204 0.75 EGLN1 (0.53) HPGDSTSHRMAPK1LMNAHTT
SCHEMBL28448861 0.75 PDGFRB (0.51) LMNAPDGFRBPDGFRANPC1RAB9A

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-1718615-A1 NOVEL QUINOLINE-CARBAXAMIDES AS JACK3 KINASE MODULATORS AstraZeneca AB (SE) 2006-11-08 EP claimed
WO-2005075429-A1 NOVEL QUINOLINE-CARBAXAMIDES AS JACK3 KINASE MODULATORS ASTRAZENECA AB (SE) 2005-08-18 WO claimed