SCHEMBL8676209

SCHEMBL8676209

Cc1ccc(P(=O)(O)OP(=O)(O)c2ccc(C)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.62
TSHR P16473 2/20 0.62
HPGD P15428 1/20 0.52
GAA P10253 3/20 0.50
CYP3A4 P08684 1/20 0.43
CA12 O43570 2/20 0.41
CA1 P00915 1/20 0.41
MMP8 P22894 1/20 0.41
TDP1 Q9NUW8 2/20 0.38
ACHE P22303 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
MMP2 P08253 1/20 0.36

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
SCHEMBL9962959 0.84 LMNA (0.60) LMNATSHRHPGDGAACYP3A4
SCHEMBL28515962 0.80 TSHR (0.59) LMNATSHRHPGDGAACYP3A4
SCHEMBL16868509 0.79 LMNA (0.54) LMNATSHRHPGDGAACYP3A4
SCHEMBL339572 0.77 LMNA (1.00) LMNATSHRHPGDGAACYP3A4
Pyrophosphoric Acid SCHEMBL28579050 0.77 LMNA (0.56) LMNATSHRHPGDGAACYP3A4
SCHEMBL109490 0.77 LMNA (0.71) LMNATSHRHPGDGAACYP3A4
SCHEMBL3888844 0.77 LMNA (0.52) LMNATSHRHPGDGAACYP3A4
SCHEMBL28351599 0.77 LMNA (0.52) LMNATSHRHPGDGAACYP3A4
SCHEMBL11813178 0.76 MMP2 (0.41) LMNATSHRCA12CA1MMP8
P-Xylene SCHEMBL28910761 0.76 LMNA (0.68) LMNATSHRHPGDGAACYP3A4

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
US-5811188-A FOR DIELECTRICS, PREPREGS OR OTHER ELECTRICAL EQUIPMEWNT SIEMENS AKTIENGESELLSCHAFT (DE) 1998-09-22 US disclosed
EP-0773968-A1 PHOSPHORUS-MODIFIED EPOXIDE RESINS, PROCESS FOR PRODUCING THE SAME AND THEIR USE SIEMENS AKTIENGESELLSCHAFT (DE) 1997-05-21 EP disclosed
WO-1996004327-A1 PHOSPHORUS-MODIFIED EPOXIDE RESINS, PROCESS FOR PRODUCING THE SAME AND THEIR USE SIEMENS AKTIENGESELLSCHAFT (DE) 1996-02-15 WO disclosed