SCHEMBL29388063

SCHEMBL29388063

C=CCN1CC[C@H](c2nc(I)c3c(N)nccn23)C1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 7/20 0.41
▸ FGFR1 P11362 4/20 0.41
▸ TNK2 Q07912 10/20 0.39
▸ FGFR2 P21802 2/20 0.38
▸ FGFR3 P22607 2/20 0.36
▸ IGF1R P08069 1/20 0.36

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
SCHEMBL24251869 0.80 FGFR4 (0.62) FGFR4FGFR1TNK2FGFR2FGFR3
SCHEMBL28911435 0.80 FGFR4 (0.62) FGFR4FGFR1TNK2FGFR2FGFR3
SCHEMBL4316054 0.77 TNK2 (0.48) FGFR1TNK2FGFR2IGF1R
SCHEMBL398874 0.77 FGFR2 (0.57) FGFR1TNK2FGFR2IGF1R
SCHEMBL28911444 0.76 FGFR4 (0.49) FGFR4FGFR1TNK2FGFR2FGFR3
SCHEMBL28911445 0.76 FGFR4 (0.49) FGFR4FGFR1TNK2FGFR2FGFR3
SCHEMBL2574101 0.74 TNK2 (0.48) FGFR4FGFR1TNK2FGFR2FGFR3
SCHEMBL1129345 0.73 TNK2 (0.56) FGFR1TNK2FGFR2IGF1R
SCHEMBL402054 0.73 TNK2 (0.59) TNK2FGFR2IGF1R
SCHEMBL401909 0.73 TNK2 (0.59) TNK2FGFR2IGF1R

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-2022033532-A1 FGFR AND MUTATION INHIBITOR THEREOF, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海和誉生物医药科技有限公司 2022-02-17 — — WO disclosed
Send feedback