SCHEMBL9168205

SCHEMBL9168205

O=P(O)(O)Cc1c(Cl)c(Cl)c(CP(=O)(O)O)c(Cl)c1Cl

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ PGK1 P00558 8/20 0.44
▸ PGK2 P07205 8/20 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
▸ GRIN2D O15399 1/20 0.32
▸ GRIN3B O60391 1/20 0.32
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2A Q12879 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ GRIN2C Q14957 1/20 0.32
▸ GRIN3A Q8TCU5 1/20 0.32
▸ PTPRB P23467 2/20 0.32
▸ TYMS P04818 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
SCHEMBL11121515 0.81 PGK1 (0.52) SMN1; SMN2PGK1PGK2KDM4EMMP2
SCHEMBL11307755 0.72 SMN1; SMN2 (1.00) SMN1; SMN2PGK1PGK2MAPK1HSD17B10
SCHEMBL13512948 0.71 PGK1 (0.44) SMN1; SMN2PGK1PGK2KDM4EMMP2
SCHEMBL11320696 0.71 PGK1 (0.62) SMN1; SMN2PGK1PGK2KDM4EMMP2
SCHEMBL13742442 0.69 PGK1 (0.60) SMN1; SMN2PGK1PGK2KDM4EMMP2
SCHEMBL3206776 0.69 PGK1 (0.43) SMN1; SMN2PGK1PGK2KDM4EMMP2
SCHEMBL3219000 0.69 PGK1 (0.43) SMN1; SMN2PGK1PGK2KDM4EMMP2
SCHEMBL6571879 0.69 PGK1 (0.60) SMN1; SMN2PGK1PGK2KDM4EMMP2
SCHEMBL11452448 0.69 PGK1 (0.48) SMN1; SMN2PGK1PGK2KDM4EMMP2
SCHEMBL6519625 0.69 PGK1 (0.48) SMN1; SMN2PGK1PGK2KDM4EMMP2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0561948-B1 PHOSPHONIC ACID DERIVATIVES USEFUL AS ANTIINFLAMMATORY AGENTS UPJOHN CO (US) 1995-04-05 — — EP claimed
EP-0561948-B1 PHOSPHONIC ACID DERIVATIVES USEFUL AS ANTIINFLAMMATORY AGENTS UPJOHN CO (US) 1995-04-05 — — EP disclosed
EP-0622373-A1 Phosphonic acid derivatives useful as anti-inflammatory agents THE UPJOHN COMPANY (US) 1994-11-02 — — EP disclosed
US-5360797-A Bisphosphonic acid derivatives useful as anti-arthritic agents THE UPJOHN COMPANY (US) 1994-11-01 — — US disclosed
US-5298498-A Antiarthritic agents THE UPJOHN COMPANY (US) 1994-03-29 — — US disclosed
EP-0561948-A1 PHOSPHONIC ACID DERIVATIVES USEFUL AS ANTIINFLAMMATORY AGENTS. UPJOHN CO (US) 1993-09-29 — — EP disclosed
WO-1992010504-A2 PHOSPHONIC ACID DERIVATIVES USEFUL AS ANTIINFLAMMATORY AGENTS THE UPJOHN COMPANY (US) 1992-06-25 — — WO disclosed
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