SCHEMBL28031119

SCHEMBL28031119

CCc1ccc2c(c1)c(OP(=O)(Oc1nc3ccccc3c3ccc(CC)cc13)C(F)F)nc1ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ KDM4E B2RXH2 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MITF O75030 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ LMNA P02545 4/20 0.35
▸ TP53 P04637 3/20 0.35
▸ RXFP1 Q9HBX9 2/20 0.35
▸ GPR3 P46089 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ HMGCR P04035 1/20 0.34
▸ MAPT P10636 5/20 0.34
▸ KIF11 P52732 1/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ RECQL P46063 1/20 0.33

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
SCHEMBL28031123 0.88 KDM4E (0.36) SMN1; SMN2KDM4EALDH1A1RAB9ANPC1
SCHEMBL28031137 0.81 CYP1A2 (0.37) KDM4EALDH1A1RAB9ANPC1MEN1
SCHEMBL28031664 0.76 KDM4E (0.40) SMN1; SMN2KDM4EALDH1A1RAB9ANPC1
SCHEMBL28031665 0.74 PDE10A (0.40) SMN1; SMN2KDM4EALDH1A1RAB9ANPC1
SCHEMBL28031138 0.70 CYP1A2 (0.40) KDM4EALDH1A1MEN1KMT2ALMNA
SCHEMBL19447775 0.70 CYP1A2 (0.47) SMN1; SMN2KDM4EALDH1A1RAB9ANPC1
SCHEMBL28031748 0.69 GPR3 (0.40) SMN1; SMN2KDM4ERAB9ANPC1MEN1
SCHEMBL28031133 0.68 GPR3 (0.45) KDM4EALDH1A1RAB9ANPC1MEN1
SCHEMBL28031751 0.68 GPR3 (0.38) SMN1; SMN2KDM4EMEN1PKMKMT2A
SCHEMBL28822264 0.67 GPR3 (0.50) SMN1; SMN2KDM4EALDH1A1KMT2ALMNA

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
CN-104844651-A Method for preparing six fluorine phosphonic acid ester base fe organism derivatives UNIV LUOYANG NORMAL 2015-08-19 — — CN disclosed
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