SCHEMBL7107526

SCHEMBL7107526

CCCCCCCCCCCCCC(=CC=Cc1ccccc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
GRIK1 P39086 1/20 0.52
LMNA P02545 2/20 0.50
EGFR P00533 1/20 0.49
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TUBB4A P04350 2/20 0.47
TUBB P07437 2/20 0.47
TUBA3C P0DPH7 2/20 0.47
TUBA1B P68363 2/20 0.47
TUBA4A P68366 2/20 0.47
TUBB4B P68371 2/20 0.47
TUBB3 Q13509 2/20 0.47
TUBB2A Q13885 2/20 0.47
TUBB8 Q3ZCM7 2/20 0.47
TUBA3E Q6PEY2 2/20 0.47
TUBA1A Q71U36 2/20 0.47
TUBA1C Q9BQE3 2/20 0.47
TUBB6 Q9BUF5 2/20 0.47

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
SCHEMBL11445983 1.00 TDP1 (0.52) TDP1GRIK1LMNAEGFRKDM4E
SCHEMBL7780529 1.00 TDP1 (0.52) TDP1GRIK1LMNAEGFRKDM4E
SCHEMBL10904990 1.00 TDP1 (0.52) TDP1GRIK1LMNAEGFRKDM4E
SCHEMBL905410 1.00 TDP1 (0.52) TDP1GRIK1LMNAEGFRKDM4E
SCHEMBL393958 0.98 GRIK1 (0.54) TDP1GRIK1LMNAEGFRKDM4E
SCHEMBL23934240 0.94 GRIK1 (0.55) TDP1GRIK1LMNAEGFRKDM4E
SCHEMBL375312 0.94 GRIK1 (0.55) TDP1GRIK1LMNAEGFRKDM4E
Maleic Acid SCHEMBL8995935 0.93 GRIK1 (0.49) TDP1GRIK1LMNAEGFRKDM4E
Juarezic Acid SCHEMBL9093401 0.91 GRIK1 (0.47) TDP1GRIK1LMNAEGFRKDM4E
Maleic Acid SCHEMBL8995943 0.89 GRIK1 (0.50) TDP1GRIK1LMNAEGFRKDM4E

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-0454980-B1 Encapsulated toners and processes thereof XEROX CORP (US) 1998-08-05 EP claimed
EP-1021472-B1 POLYMER COMPOSITION NAT STARCH CHEM INVEST (US) 2003-10-22 EP disclosed
US-6372846-B1 A POLY(ALKYL(METH)ACRYLATE) BASE POLYMER AND A RUBBER TOUGHENING AGENT PRESENT AS DISCRETE ISLANDS AND SUB-ISLANDS, CONFINED BY THE BASE POLYMER; MOULDINGS; IMPACT STRENGTH; EXTERNAL LIGHT CLUSTERS FOR AUTOMOBILES NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2002-04-16 US disclosed
EP-1021472-A1 POLYMER COMPOSITION Ineos Acrylics UK Limited (GB) 2000-07-26 EP disclosed
WO-1999012986-A1 POLYMER COMPOSITION INEOS ACRYLICS UK LIMITED (GB) 1999-03-18 WO disclosed