SCHEMBL30117485

SCHEMBL30117485

Nc1noc2cc(-c3cccnc3-c3ccc(F)c(Cl)c3)ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ FLT3 P36888 1/20 0.42
▸ EPHB4 P54760 3/20 0.41
▸ FEN1 P39748 1/20 0.41
▸ KMO O15229 1/20 0.40
▸ TGFBR1 P36897 2/20 0.39
▸ MET P08581 1/20 0.39
▸ SCN9A Q15858 3/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ ADORA2A P29274 1/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ EPHX2 P34913 1/20 0.37
▸ CYP11B2 P19099 1/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ TDO2 P48775 2/20 0.36
▸ F10 P00742 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
SCHEMBL15638599 1.00 KIT (0.42) KITKDRFLT3EPHB4FEN1
SCHEMBL30117560 0.91 SCN9A (0.47) KITKDRFLT3EPHB4FEN1
SCHEMBL15638471 0.91 SCN9A (0.47) KITKDRFLT3EPHB4FEN1
SCHEMBL15638535 0.87 TGFBR1 (0.44) KITKDRFLT3FEN1KMO
SCHEMBL15638699 0.86 MAP4K4 (0.44) KITKDRFLT3FEN1TGFBR1
SCHEMBL30117552 0.86 MAP4K4 (0.44) KITKDRFLT3FEN1TGFBR1
SCHEMBL15638775 0.82 FEN1 (0.49) KITKDRFLT3FEN1TGFBR1
SCHEMBL15638894 0.79 JAK2 (0.46) KDREPHB4FEN1KMOTGFBR1
SCHEMBL15638247 0.78 DHFR (0.52) EPHB4FEN1KMOTGFBR1ADORA2A
SCHEMBL15638882 0.78 TGFBR1 (0.48) KITKDRFLT3FEN1KMO

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
EP-2903978-B1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2022-12-07 — — EP claimed
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