SCHEMBL28031691

SCHEMBL28031691

Cc1ccc2nc(OP(C)(=O)O)c3ccccc3c2c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ NQO2 P16083 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ DHODH Q02127 1/20 0.39
▸ MAPT P10636 5/20 0.38
▸ LMNA P02545 1/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CREBBP Q92793 1/20 0.37
▸ ELANE P08246 1/20 0.37
▸ MEN1 O00255 1/20 0.37

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
SCHEMBL28031135 0.90 GPR3 (0.42) KDM4EALDH1A1HSD17B10NQO2MAOA
SCHEMBL28031690 0.89 NQO2 (0.42) KDM4EALDH1A1HSD17B10NQO2MAOA
SCHEMBL28822266 0.85 GPR3 (0.47) KDM4EHSD17B10L3MBTL1LMNAKMT2A
SCHEMBL28031130 0.85 DHODH (0.39) ALDH1A1DHODH
SCHEMBL28031131 0.80 MAPT (0.37) KDM4EALDH1A1HSD17B10L3MBTL1TDP1
SCHEMBL28031133 0.79 GPR3 (0.45) KDM4EALDH1A1HSD17B10NQO2MAOA
SCHEMBL8350089 0.77 ALDH1A1 (0.52) KDM4EALDH1A1NQO2MAOAL3MBTL1
SCHEMBL28031124 0.76 DHODH (0.39) KDM4EDHODHLMNA
SCHEMBL28031751 0.76 GPR3 (0.38) KDM4EL3MBTL1TDP1DHODHMAPT
SCHEMBL28031193 0.75 ALDH1A1 (0.38) KDM4EALDH1A1L3MBTL1MAPK1TDP1

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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