SCHEMBL7210992

SCHEMBL7210992

C=CCO[PH](=O)c1ccc(C(=O)c2c(C)cc(C)cc2C)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.45
KMT2A Q03164 2/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.42
MCOLN3 Q8TDD5 1/20 0.42
CRHR1 P34998 3/20 0.38
KDM4E B2RXH2 1/20 0.35
PDE4B Q07343 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ELANE P08246 1/20 0.32
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
PTPN1 P18031 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL335891 0.83 HPGD (0.52) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL1029468 0.79 KMT2A (0.49) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL7210994 0.79 CYP3A4 (0.38) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL1033664 0.75 HPGD (0.52) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL3685862 0.75 KMT2A (0.54) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL5713051 0.74 KMT2A (0.53) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL1517886 0.73 KMT2A (0.43) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL28274214 0.72 KMT2A (0.67) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL21239622 0.71 HPGD (0.39) HPGDKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL28242772 0.71 KMT2A (0.65) HPGDKMT2ALMNAMEN1SMN1; SMN2

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
EP-0948955-B1 POLYMERIZABLE DENTAL COMPOSITION KURARAY CO (JP) 2003-09-03 EP disclosed
US-6191191-B1 USED AS BONDING AGENT, COMPOSITE RESIN, ADHESIVE AGENT, PRIMER AND OPAQUE PRIMER FOR DENTAL USE; LIGHT RESISTANCE; ADHESION TO TOOTH SURFACE AND METALS; COLORFASTNESS KURARAY CO., LTD. (JP) 2001-02-20 US disclosed
EP-0948955-A1 POLYMERIZABLE DENTAL COMPOSITION KURARAY CO., LTD. (JP) 1999-10-13 EP disclosed