SCHEMBL5818607

SCHEMBL5818607

Cc1ccc([N+](=O)[O-])cc1N1Cc2cnc3[nH]ccc3c2N(C)C1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 8/20 0.57
▸ FGFR3 P22607 8/20 0.57
▸ KDR P35968 8/20 0.57
▸ FGFR2 P21802 7/20 0.57
▸ PDGFRB P09619 3/20 0.55
▸ KIT P10721 3/20 0.55
▸ NTRK1 P04629 1/20 0.55
▸ JAK2 O60674 2/20 0.43
▸ JAK3 P52333 2/20 0.43
▸ JAK1 P23458 1/20 0.43
▸ TYK2 P29597 1/20 0.43
▸ AURKB Q96GD4 1/20 0.38
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ LCK P06239 3/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ TSHR P16473 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAPT P10636 1/20 0.34

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
SCHEMBL5814256 0.85 FGFR1 (0.62) FGFR1FGFR3KDRFGFR2PDGFRB
SCHEMBL5814252 0.82 FGFR1 (0.58) FGFR1FGFR3KDRFGFR2PDGFRB
SCHEMBL19922636 0.75 TNK2 (0.42) FGFR1FGFR3KDRPDGFRBKIT
SCHEMBL15583173 0.73 FGFR1 (1.00) FGFR1FGFR3KDRFGFR2PDGFRB
SCHEMBL5813589 0.73 TNK2 (0.61) FGFR1FGFR3KDRFGFR2PDGFRB
SCHEMBL3139215 0.72 LCK (0.41) FGFR1FGFR3KDRPDGFRBKIT
SCHEMBL15555862 0.71 FGFR1 (1.00) FGFR1FGFR3KDRFGFR2PDGFRB
SCHEMBL15556309 0.71 FGFR1 (1.00) FGFR1FGFR3KDRFGFR2PDGFRB
SCHEMBL15583164 0.71 FGFR1 (1.00) FGFR1FGFR3KDRFGFR2PDGFRB
SCHEMBL15556704 0.71 FGFR1 (1.00) FGFR1FGFR3KDRFGFR2PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006124731-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-11-23 — — WO disclosed
Send feedback