SCHEMBL9700929

SCHEMBL9700929

O=P(O)(O)Cc1nc2cc(F)c(F)cc2nc1CBr

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 1/20 0.39
FDPS P14324 1/20 0.39
PGK1 P00558 1/20 0.34
PGK2 P07205 1/20 0.34
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 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
SCHEMBL9699572 0.82 ERBB2 (0.39)
SCHEMBL9741739 0.75
SCHEMBL9740717 0.70 SMN1; SMN2 (0.41) PGK1PGK2MMP1MMP2MMP3
SCHEMBL30932254 0.63 KDM4E (0.52)
SCHEMBL22973707 0.60 PGK1 (0.61) PGK1PGK2
SCHEMBL19470934 0.58 NQO2 (0.52)
SCHEMBL578007 0.58 PGK1 (0.54) PGK1PGK2
SCHEMBL10846210 0.58 KDM4E (0.38)
SCHEMBL30932262 0.57 PABPC1 (0.47)
SCHEMBL9700631 0.57 NQO2 (0.52) PGK1

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-1992014740-A1 QUINOXALINE PHOSPHONO-AMINO ACIDS AMERICAN HOME PRODUCTS CORPORATION (US) 1992-09-03 WO disclosed
US-5118675-A Therapy for central nervous system disorders AMERICAN HOME PRODUCTS CORPORATION (US) 1992-06-02 US disclosed