Sugi Predict

Sugi Predict / Compounds / SCHEMBL7948530

SCHEMBL7948530

SCHEMBL7948530

COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCCCSc1nccn1C.COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCCCn1ccccc1=O

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FLT1 P17948 19/20 0.60
▸ KDR P35968 19/20 0.60
▸ FGFR1 P11362 17/20 0.60
▸ FLT4 P35916 12/20 0.60
▸ EGFR P00533 11/20 0.60
▸ FGFR2 P21802 1/20 0.58
▸ FGFR4 P22455 1/20 0.58
▸ FGFR3 P22607 1/20 0.58
▸ EPHB2 P29323 1/20 0.55

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
SCHEMBL7457026 0.91 FLT1 (0.69) FLT1KDRFGFR1FLT4EGFR
SCHEMBL7460861 0.91 FLT1 (0.71) FLT1KDRFGFR1FLT4EGFR
SCHEMBL7448277 0.87 FLT1 (0.72) FLT1KDRFGFR1FLT4EGFR
SCHEMBL7460639 0.87 FLT1 (0.70) FLT1KDRFGFR1FLT4EGFR
SCHEMBL7452365 0.81 FLT1 (0.71) FLT1KDRFGFR1FLT4EGFR
Hydrochloric Acid SCHEMBL7450382 0.80 FLT1 (0.72) FLT1KDRFGFR1FLT4EGFR
SCHEMBL7455061 0.80 FLT1 (0.72) FLT1KDRFGFR1FLT4EGFR
Hydrochloric Acid SCHEMBL7712373 0.79 FLT1 (0.71) FLT1KDRFGFR1FLT4EGFR
SCHEMBL7459187 0.78 FLT1 (0.72) FLT1KDRFGFR1FLT4EGFR
SCHEMBL1467915 0.78 FLT1 (0.79) FLT1KDRFGFR1FLT4EGFR

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
US-6258951-B1 ANTICANCER, ANTIARTHRITIC AGENTS ZENECA LIMITED (GB) 2001-07-10 — — US disclosed