SCHEMBL9167446

SCHEMBL9167446

Cc1cccc(C)c1OC(=O)CCc1ccc(OP(Oc2ccc(CCC(=O)Oc3c(C)cccc3C)cc2C(C)(C)C)Oc2ccc(CCC(=O)Oc3c(C)cccc3C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
FFAR4 Q5NUL3 7/20 0.38
KMT2A Q03164 2/20 0.38
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.38
AKR1C3 P42330 3/20 0.37
SCN2A Q99250 2/20 0.36
ALDH1A1 P00352 1/20 0.36
FFAR1 O14842 6/20 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
SCHEMBL9171483 0.85 LMNA (0.41) L3MBTL1FFAR4KMT2AMEN1AKR1C3
SCHEMBL9169230 0.84 KMT2A (0.45) FFAR4KMT2AAKR1C3FFAR1
SCHEMBL9172721 0.83 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1KMT2AATMMEN1
SCHEMBL2612488 0.82 GAA (0.42) KMT2AMEN1
SCHEMBL9170757 0.81 KMT2A (0.40) L3MBTL1KMT2AFFAR1
SCHEMBL9858174 0.78 FFAR4 (0.44) L3MBTL1FFAR4KMT2AMEN1AKR1C3
SCHEMBL9172712 0.76 APP (0.41) L3MBTL1AKR1C3ALDH1A1
SCHEMBL13160827 0.75 GAA (0.39) SMN1; SMN2KMT2A
SCHEMBL13893849 0.75 PTPN1 (0.36) SMN1; SMN2KMT2AALDH1A1
SCHEMBL9170338 0.74 THRA (0.44) ALDH1A1

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-0335262-B1 Phosphite compounds YOSHITOMI PHARMACEUTICAL (JP) 1995-05-31 EP disclosed
US-5077424-A Antioxidants YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-12-31 US disclosed
EP-0335262-A2 Phosphite compounds YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-10-04 EP disclosed