SCHEMBL24865751

SCHEMBL24865751

CNc1ncc(Nc2ccc(N3CCC(C(F)(F)F)CC3)c(OC)c2)cc1OCC=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 14/20 0.39
KCNH2 Q12809 2/20 0.39
FGFR1 P11362 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39
KDR P35968 1/20 0.39
LRRK2 Q5S007 1/20 0.38
EGFR P00533 1/20 0.37
IGF1R P08069 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
TNIK Q9UKE5 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 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
SCHEMBL24865126 0.78 TNIK (0.39) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL24865544 0.76 BCL6 (0.35) LRRK2EGFRKDM4EMAPT
SCHEMBL24865437 0.75 BCL6 (0.38) FGFR3KCNH2EGFRKDM4EMAPT
SCHEMBL24864955 0.74 KDM4E (0.36) LRRK2EGFRKDM4EMAPT
SCHEMBL24865335 0.74 KIT (0.35) FGFR3KCNH2EGFRKDM4EMAPT
SCHEMBL24865140 0.73 GABRG2 (0.46) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL30885129 0.73 GABRG2 (0.46) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL31123225 0.73 IGF1R (0.39) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL24865175 0.73 IGF1R (0.39) FGFR3KCNH2FGFR1FGFR2FGFR4
SCHEMBL24865747 0.71 LRRK2 (0.37) LRRK2

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-2023280296-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-01-12 WO disclosed