SCHEMBL4594819

SCHEMBL4594819

CC(C)C[C@@H](C(=O)O)N(C(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.43
FABP7 O15540 2/20 0.43
KMT2A Q03164 2/20 0.41
CASP3 P42574 2/20 0.40
EPHX2 P34913 1/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39
MDM4 O15151 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL27264009 0.95 FABP5 (0.42) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL31520502 0.93 CTSK (0.41) FABP5FABP7KMT2A
SCHEMBL29157252 0.91 KMT2A (0.45) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL29401170 0.89 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL3728170 0.89 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL31732619 0.89 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL30896130 0.89 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL29400870 0.89 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL119027 0.89 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL29908641 0.89 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1314745-B1 Process for preparing trityl group containing polystyrene resins UNB CHEMICAL CORP (KR) 2008-01-09 EP disclosed
US-6875822-B2 Process for preparing tritylated polystyrene resin BEADTECH, INC. (KR) 2005-04-05 US disclosed
US-20030105243-A1 Process for preparing tritylated polystylene resin UNB CHEMICAL CORPORATION (KR) 2003-06-05 US disclosed
EP-1314745-A1 Process for preparing trityl group containing polystyrene resins Beadtech Inc. (KR) 2003-05-28 EP disclosed