SCHEMBL11320696

SCHEMBL11320696

Cc1c(C)c(CP(=O)(O)O)c(C)c(C)c1CP(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PGK1 P00558 5/20 0.62
▸ PGK2 P07205 5/20 0.62
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ ENPP2 Q13822 1/20 0.33
▸ PTPRB P23467 2/20 0.32
▸ TYMS P04818 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ ACP3 P15309 1/20 0.31

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
SCHEMBL13742442 0.97 PGK1 (0.60) PGK1PGK2SMN1; SMN2KDM4EMMP2
SCHEMBL6571879 0.92 PGK1 (0.60) PGK1PGK2SMN1; SMN2KDM4EMMP2
SCHEMBL18957741 0.90 PGK1 (0.54) PGK1PGK2SMN1; SMN2PTPRB
SCHEMBL11121515 0.81 PGK1 (0.52) PGK1PGK2SMN1; SMN2KDM4EMMP2
SCHEMBL11452448 0.74 PGK1 (0.48) PGK1PGK2SMN1; SMN2KDM4EMMP2
SCHEMBL6519625 0.74 PGK1 (0.48) PGK1PGK2SMN1; SMN2KDM4EMMP2
SCHEMBL12606470 0.74 PGK1 (0.48) PGK1PGK2SMN1; SMN2
SCHEMBL11306957 0.72 PGK1 (0.69) PGK1PGK2SMN1; SMN2THRBPTPRB
SCHEMBL13512948 0.71 PGK1 (0.44) PGK1PGK2SMN1; SMN2KDM4EMMP2
SCHEMBL9168205 0.71 SMN1; SMN2 (0.56) PGK1PGK2SMN1; SMN2KDM4EMMP2

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
US-4268459-A FIREPROOFING FOR THERMOPLASTIC RESINS AMERICAN CYANAMID COMPANY (US) 1981-05-19 — — US disclosed
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