SCHEMBL5160749

SCHEMBL5160749

CCC(=CC(C=CC(=O)O)=Cc1ccccc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
HTT P42858 1/20 0.43
AKR1C3 P42330 1/20 0.42
HDAC3 O15379 1/20 0.41
TNKS O95271 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL6572696 0.85 RECQL (0.51) CYP3A4CYP2C9HTTAKR1C3HDAC3
SCHEMBL294650 0.84 CYP3A4 (0.42) CYP3A4CYP2C9HTTAKR1C3RECQL
SCHEMBL2785101 0.83 CYP3A4 (0.41) CYP3A4CYP2C9HTTAKR1C3RECQL
SCHEMBL5163102 0.82 AKR1C3 (0.54) CYP3A4CYP2C9HTTAKR1C3RECQL
SCHEMBL18172652 0.81 ALDH1A1 (0.52) CYP3A4CYP2C9HTTAKR1C3RECQL
SCHEMBL8073194 0.81 ALDH1A1 (0.52) CYP3A4CYP2C9HTTAKR1C3RECQL
SCHEMBL1456939 0.80 AKR1C3 (0.59) CYP3A4CYP2C9HTTAKR1C3HDAC3
SCHEMBL2042270 0.79 LMNA (0.49) CYP3A4CYP2C9HTTAKR1C3RECQL
SCHEMBL5340490 0.78 CYP3A4 (0.42) CYP3A4CYP2C9HTTAKR1C3RECQL
SCHEMBL2918640 0.78 CYP3A4 (0.63) CYP3A4CYP2C9HTTAKR1C3RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1273452-B1 Ink jet printing method and apparatus CANON KK (JP) 2007-03-28 EP disclosed
EP-0703087-B1 Ink jet printing method and apparatus CANON KK (JP) 2003-05-14 EP disclosed
EP-1273452-A1 Ink jet printing method and apparatus CANON KABUSHIKI KAISHA (JP) 2003-01-08 EP disclosed
US-20020140790-A1 Ink jet printing method and apparatus CANON KABUSHIKI KAISHA (JP) 2002-10-03 US disclosed
EP-0703087-A2 Ink jet printing method and apparatus CANON KABUSHIKI KAISHA (JP) 1996-03-27 EP disclosed