SCHEMBL8717162

SCHEMBL8717162

CCC(=O)OCc1c2ccccc2cc2ccccc12.CCCS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
ALDH1A1 P00352 7/20 0.47
GAA P10253 2/20 0.43
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
NOD2 Q9HC29 1/20 0.39
NOD1 Q9Y239 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
SCHEMBL4809140 0.82 EPHX1 (0.51) LMNAALDH1A1KMT2AMEN1
SCHEMBL8716445 0.81 RAD52 (0.42) LMNAALDH1A1GAAKMT2AMAPT
SCHEMBL7271976 0.75 TDP1 (0.54) ALDH1A1KMT2AMEN1
SCHEMBL8716442 0.74 GAA (0.39) LMNAALDH1A1GAAKMT2AMAPT
SCHEMBL8371950 0.72 RXFP1 (0.57) LMNAALDH1A1KMT2AMAPTMEN1
SCHEMBL28324765 0.71 EPHX1 (0.51) ALDH1A1KMT2AMEN1
SCHEMBL14277073 0.70 EPHX1 (0.56) ALDH1A1GAAKMT2AMEN1
SCHEMBL17323587 0.70 EPHX1 (0.48) LMNAALDH1A1KMT2AMAPTMEN1
SCHEMBL92881 0.70 ALDH1A1 (0.72) LMNAALDH1A1GAAKMT2AMAPT
SCHEMBL29122617 0.70 TDP1 (0.58) LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5780206-A USING AN ANTHRACENE DERIVATIVE AS AN ABSORBER ON HIGHLY REFLECTIVE SURFACES; ALKALI-SOLUBLE POLYMERS; GENERATION OF ACID CATALYSTS; FINE PATTERNS WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1998-07-14 US disclosed
US-5695910-A RESIN BECOMES ALKALI SOLUBLE BY ELIMINATING PROTECTIVE GROUPS BY ACTION OF IN SITU GENERATED ACID WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-09 US disclosed