SCHEMBL6917308

SCHEMBL6917308

CC(C)(Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)C(=O)CO[PH](=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.49
HPN P05981 1/20 0.49
MAPT P10636 1/20 0.49
SIRT5 Q9NXA8 1/20 0.49
VCAM1 P19320 13/20 0.47
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
GPR55 Q9Y2T6 1/20 0.36
LMNA P02545 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL6917312 0.90 ALOX15 (0.50) ALOX15HPNMAPTSIRT5VCAM1
SCHEMBL9390779 0.90 VCAM1 (0.44) ALOX15HPNMAPTSIRT5VCAM1
SCHEMBL6909365 0.81 HPN (0.41) ALOX15HPNMAPTSIRT5VCAM1
SCHEMBL9390783 0.81 VCAM1 (0.45) ALOX15HPNMAPTSIRT5VCAM1
SCHEMBL9390321 0.78 VCAM1 (0.40) ALOX15HPNMAPTSIRT5VCAM1
SCHEMBL9279665 0.78 VCAM1 (0.35) ALOX15HPNMAPTSIRT5VCAM1
SCHEMBL9394063 0.76 ALOX5 (0.48) MAPTCA1CA2GPR55LMNA
SCHEMBL6918409 0.75 VCAM1 (0.45) ALOX15HPNMAPTSIRT5VCAM1
SCHEMBL6914648 0.74 HMGCR (0.43) ALOX15HPNMAPTSIRT5VCAM1
SCHEMBL27427059 0.73 HPN (0.49) ALOX15HPNMAPTSIRT5VCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1994019358-A1 SUBSTITUTED PHOSPHONATES, THE PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYMPHAR S.A. (CH) 1994-09-01 WO claimed
WO-2004026245-A2 SUBSTITUTED PHOSPHONATE COMPOUNDS HAVING BONE ANABOLIC ACTIVITY ILEX ONCOLOGY RESEARCH, SARL (CH) 2004-04-01 WO disclosed
EP-0638084-A1 SUBSTITUTED PHOSPHONATES, THE PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYMPHAR S.A. (CH) 1995-02-15 EP disclosed