SCHEMBL31647773

SCHEMBL31647773

COc1cc(OC)cc(-c2cc3ccc(NCCCc4ccccc4)nc3nc2N)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGDR Q13258 1/20 0.50
▸ FGFR1 P11362 8/20 0.46
▸ KDR P35968 6/20 0.45
▸ FGFR2 P21802 2/20 0.45
▸ FGFR4 P22455 2/20 0.45
▸ FGFR3 P22607 2/20 0.45
▸ ACP1 P24666 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39

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
SCHEMBL31647879 0.85 FGFR1 (0.52) FGFR1KDRFGFR2FGFR4FGFR3
SCHEMBL31648011 0.85 FGFR1 (0.49) FGFR1KDRFGFR2FGFR4FGFR3
SCHEMBL31647959 0.82 FGFR1 (0.46) FGFR1KDRFGFR2FGFR4FGFR3
SCHEMBL31647914 0.82 FGFR1 (0.46) FGFR1KDRFGFR2FGFR4FGFR3
SCHEMBL31648028 0.79 FGFR1 (0.61) FGFR1KDRFGFR2FGFR4FGFR3
SCHEMBL31648220 0.79 FGFR1 (0.44) FGFR1KDRFGFR2FGFR4FGFR3
SCHEMBL31648041 0.72 TLR8 (0.41) CYP1A2CYP3A4
SCHEMBL31648629 0.71 FGFR1 (0.47) FGFR1KDRFGFR2FGFR4FGFR3
SCHEMBL31648364 0.70 FGFR1 (0.60) FGFR1KDRFGFR2FGFR4FGFR3
SCHEMBL31648190 0.70 FGFR1 (0.40) FGFR1KDRFGFR2FGFR4FGFR3

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
WO-2025132449-A1 NOVEL COMPOUNDS FOR HOST DIRECTED ANTIVIRAL STRATEGY SORBONNE UNIVERSITE (FR) 2025-06-26 — — WO disclosed
WO-2025133660-A1 NOVEL COMPOUNDS FOR HOST DIRECTED ANTIVIRAL STRATEGY SORBONNE UNIVERSITE (FR) 2025-06-26 — — WO disclosed
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