SCHEMBL28031124

SCHEMBL28031124

CP(=O)(O)Oc1nc2ccccc2c2ccc(-c3ccccc3)cc12

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.39
▸ GPR3 P46089 1/20 0.38
▸ TRIM58 Q8NG06 1/20 0.35
▸ ACP3 P15309 1/20 0.35
▸ TSPO P30536 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ DHFR P00374 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ACACA Q13085 1/20 0.35
▸ MMP13 P45452 1/20 0.34
▸ GPR84 Q9NQS5 1/20 0.34

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
SCHEMBL28031122 0.89 GPR3 (0.40) DHODHGPR3TRIM58TSPOBRD4
SCHEMBL28822266 0.86 GPR3 (0.47) GPR3TSPOPARP1LMNAKDM4E
SCHEMBL28031135 0.85 GPR3 (0.42) GPR3SMN1; SMN2KDM4E
SCHEMBL28031751 0.84 GPR3 (0.38) DHODHGPR3SMN1; SMN2KDM4E
SCHEMBL28031125 0.83 KDM4E (0.44) LMNASMN1; SMN2KDM4EHPGD
SCHEMBL28031746 0.81 MAT2A (0.39) DHODHGPR3ACP3LMNA
SCHEMBL28031665 0.80 PDE10A (0.40) DHODHGPR3PARP1LMNASMN1; SMN2
SCHEMBL28031691 0.76 KDM4E (0.41) DHODHLMNAKDM4E
SCHEMBL28031130 0.75 DHODH (0.39) DHODH
SCHEMBL28031159 0.74 KDM4E (0.38) DHODHACP3PARP1KDM4E

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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