SCHEMBL86955

SCHEMBL86955

C=CC(=O)Oc1ccc2c3c(ccc2c1)OCC3=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
TYMS P04818 1/20 0.36
CYP2C9 P11712 1/20 0.35
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35
THRB P10828 2/20 0.34
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
TRPV1 Q8NER1 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAPDH P04406 1/20 0.32

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
SCHEMBL87534 0.88 GRM5 (0.41) ALDH1A1SMN1; SMN2TYMSCA12CA9
SCHEMBL12216194 0.80 MAPT (0.49) MAPTKMT2AMEN1HSD17B10ALDH1A1
SCHEMBL802754 0.77 THRB (0.47) MAPTKMT2AMEN1HSD17B10ALDH1A1
SCHEMBL87291 0.75 MAPT (0.50) MAPTKMT2AMEN1HSD17B10ALDH1A1
SCHEMBL819722 0.73 THRB (0.53) MAPTKMT2AMEN1HSD17B10ALDH1A1
SCHEMBL19155399 0.73 CA12 (0.49) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL15292034 0.70 ALDH1A1 (0.47) MAPTKMT2AMEN1HSD17B10ALDH1A1
SCHEMBL18869506 0.70 KDM4E (0.49) MAPTKMT2AMEN1HSD17B10ALDH1A1
SCHEMBL18468609 0.70 KMT2A (0.46) MAPTKMT2AMEN1THRBTDP1
SCHEMBL27909784 0.70 TRPV1 (0.54) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2053095-B2 Ink composition and inkjet recording method using the same FUJIFILM CORP (JP) 2017-02-22 EP disclosed
EP-2053095-B1 Ink composition and inkjet recording method using the same FUJIFILM CORP (JP) 2014-03-26 EP disclosed
US-8129447-B2 Ink composition and inkjet recording method using the same FUJIFILM CORPORATION (JP) 2012-03-06 US disclosed
US-8129447-B2 Ink composition and inkjet recording method using the same FUJIFILM CORPORATION (JP) 2012-03-06 US disclosed
EP-2053095-A2 Ink composition and inkjet recording method using the same Fujifilm Corporation (JP) 2009-04-29 EP disclosed
US-20090087575-A1 INK COMPOSITION AND INKJET RECORDING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20090087575-A1 INK COMPOSITION AND INKJET RECORDING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2009-04-02 US 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 (1 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-20090087575-A1 INK COMPOSITION AND INKJET RECORDING METHOD USING THE SAME RB1, IK, NOX1 MAPT 2087/4885KMT2A 90/4885MEN1 4036/4885

“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.