SCHEMBL12354596

SCHEMBL12354596

CC(=O)CC(=O)CCc1ccc(COC2CCCCO2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 2/20 0.42
EP300 Q09472 1/20 0.42
ICAM1 P05362 1/20 0.41
SELE P16581 1/20 0.41
MGLL Q99685 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
F2RL1 P55085 1/20 0.39
CCR5 P51681 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 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
SCHEMBL10007917 0.80 ICAM1 (0.45) CREBBPEP300ICAM1SELEMGLL
SCHEMBL22334887 0.79 MEN1 (0.47) CREBBPICAM1SELEMGLLMEN1
SCHEMBL16639666 0.79 CREBBP (0.48) CREBBPEP300ICAM1SELEMEN1
SCHEMBL10817780 0.78 ICAM1 (0.41) CREBBPEP300ICAM1SELEMGLL
SCHEMBL20857101 0.78 NPSR1 (0.45) CREBBPEP300ICAM1SELEMEN1
SCHEMBL3809200 0.78 KMT2A (0.48) CREBBPEP300ICAM1SELEMEN1
SCHEMBL22334888 0.77 MGLL (0.48) CREBBPICAM1SELEMGLLMEN1
SCHEMBL4317051 0.76 ICAM1 (0.45) CREBBPEP300ICAM1SELEMEN1
SCHEMBL3811958 0.76 KMT2A (0.64) CREBBPEP300ICAM1SELEMEN1
SCHEMBL20857107 0.75 KMT2A (0.45) CREBBPEP300ICAM1SELEMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8721922-B2 Printable light-emitting compositions NITTO DENKO CORPORATION (JP) 2014-05-13 US disclosed
US-8721922-B2 Printable light-emitting compositions NITTO DENKO CORPORATION (JP) 2014-05-13 US disclosed
US-20120305895-A1 LIGHT EMITTING DEVICES AND COMPOSITIONS NITTO DENKO CORPORATION (JP) 2012-12-06 US disclosed
US-20120305895-A1 LIGHT EMITTING DEVICES AND COMPOSITIONS NITTO DENKO CORPORATION (JP) 2012-12-06 US disclosed
US-20110193075-A1 PRINTABLE LIGHT-EMITTING COMPOSITIONS NITTO DENKO CORPORATION (JP) 2011-08-11 US disclosed
US-20110193075-A1 PRINTABLE LIGHT-EMITTING COMPOSITIONS NITTO DENKO CORPORATION (JP) 2011-08-11 US disclosed
WO-2010045263-A2 PRINTABLE LIGHT-EMITTING COMPOSITIONS NITTO DENKO CORPORATION (JP) 2010-04-22 WO disclosed
US-20090066234-A1 LIGHT EMITTING DEVICES AND COMPOSITIONS NITTO DENKO CORPORATION (JP) 2009-03-12 US disclosed
US-20090066234-A1 LIGHT EMITTING DEVICES AND COMPOSITIONS NITTO DENKO CORPORATION (JP) 2009-03-12 US disclosed
WO-2009006550-A1 LIGHT EMITTING DEVICES AND COMPOSITIONS NITTO DENKO CORPORATION (JP) 2009-01-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090066234-A1 LIGHT EMITTING DEVICES AND COMPOSITIONS MAP1LC3A, MAP1LC3C, CRY1 CREBBP 4718/4885EP300 2827/4885ICAM1 598/4885
US-20120305895-A1 LIGHT EMITTING DEVICES AND COMPOSITIONS ILK, CRY1, IK CREBBP 4703/4885EP300 2001/4885ICAM1 375/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.