SCHEMBL5776199

SCHEMBL5776199

Nc1nc(-c2ccc3c(c2)C(=Cc2cc(Cl)c(O)c(Cl)c2)C(=O)N3)cs1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 8/20 0.64
▸ KIF15 Q9NS87 2/20 0.48
▸ ULK1 O75385 1/20 0.48
▸ PLK4 O00444 2/20 0.48
▸ PLK1 P53350 2/20 0.48
▸ LRRK2 Q5S007 5/20 0.47
▸ PSEN1 P49768 2/20 0.47
▸ PSEN2 P49810 2/20 0.47
▸ APH1B Q8WW43 2/20 0.47
▸ NCSTN Q92542 2/20 0.47
▸ APH1A Q96BI3 2/20 0.47
▸ PSENEN Q9NZ42 2/20 0.47
▸ PIK3C3 Q8NEB9 1/20 0.46
▸ EGFR P00533 2/20 0.45
▸ ERBB2 P04626 1/20 0.45
▸ PDGFRB P09619 1/20 0.45
▸ POLB P06746 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43

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
SCHEMBL5776196 1.00 RAF1 (0.64) RAF1KIF15ULK1PLK4PLK1
SCHEMBL5774037 0.89 RAF1 (0.62) RAF1KIF15ULK1PLK4PLK1
SCHEMBL5774040 0.89 RAF1 (0.62) RAF1KIF15ULK1PLK4PLK1
SCHEMBL1395120 0.88 LRRK2 (0.64) RAF1KIF15PLK4PLK1LRRK2
SCHEMBL1395119 0.88 LRRK2 (0.64) RAF1KIF15PLK4PLK1LRRK2
SCHEMBL5776685 0.86 RAF1 (0.71) RAF1KIF15ULK1PLK4PLK1
SCHEMBL5776688 0.86 RAF1 (0.71) RAF1KIF15ULK1PLK4PLK1
SCHEMBL12856457 0.84 LRRK2 (0.51) RAF1KIF15PLK4PLK1LRRK2
SCHEMBL5777026 0.83 RAF1 (0.63) RAF1KIF15ULK1PLK4PLK1
SCHEMBL5777022 0.83 RAF1 (0.63) RAF1KIF15ULK1PLK4PLK1

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-1003721-B1 BENZYLIDENE-1,3-DIHYDRO-INDOL-2-ONE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS, PARTICULARLY OF RAF KINASES GLAXO GROUP LTD (GB) 2006-11-02 — — EP disclosed
US-6268391-B1 Benzylidene-1,3-dihydro-indol-2-one derivatives a receptor tyrosine kinase inhibitors, particularly of Raf kinases GLAXO WELLCOME INC. 2001-07-31 — — US disclosed
Send feedback