SCHEMBL803143

SCHEMBL803143

C=C(C)C(=O)Oc1ccc2c(c1)oc(=O)c1cc(OC(=O)C(=C)C)ccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.60
KDM4E B2RXH2 9/20 0.60
MAPT P10636 6/20 0.60
POLB P06746 5/20 0.60
RAB9A P51151 2/20 0.60
NPC1 O15118 1/20 0.60
STAT1 P42224 1/20 0.60
KMT2A Q03164 4/20 0.54
RXFP1 Q9HBX9 2/20 0.54
PPARG P37231 1/20 0.54
NCOA2 Q15596 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
L3MBTL1 Q9Y468 3/20 0.50
LMNA P02545 1/20 0.50
MEN1 O00255 2/20 0.49
AKR1C3 P42330 1/20 0.47
AKR1C2 P52895 1/20 0.47
AKR1C1 Q04828 1/20 0.47
GAA P10253 4/20 0.47
GLA P06280 3/20 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
SCHEMBL7906961 0.86 KDM4E (0.61) ALDH1A1KDM4EPOLBRAB9ANPC1
SCHEMBL15291998 0.81 ESR2 (0.52) ALDH1A1KDM4EMAPTPOLBRAB9A
SCHEMBL7852230 0.81 KDM4E (0.78) ALDH1A1KDM4EMAPTPOLBRAB9A
SCHEMBL7920869 0.80 ALDH1A1 (0.75) ALDH1A1KDM4EMAPTKMT2ALMNA
SCHEMBL30862481 0.80 ALDH1A1 (0.75) ALDH1A1KDM4EMAPTKMT2ALMNA
SCHEMBL23299732 0.79 ALDH1A1 (0.61) ALDH1A1KDM4EMAPTPOLBRAB9A
SCHEMBL26768218 0.78 KDM4E (0.60) ALDH1A1KDM4EMAPTPOLBRAB9A
SCHEMBL26780129 0.78 PDE2A (0.65) ALDH1A1KDM4EMAPTPOLBRAB9A
SCHEMBL26780127 0.78 MAPT (0.72) ALDH1A1KDM4EMAPTPOLBRAB9A
SCHEMBL26577339 0.78 ALDH1A1 (0.66) ALDH1A1KDM4EMAPTPOLBRAB9A

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
US-9096795-B2 Liquid crystal display MERCK PATENT GMBH (DE) 2015-08-04 US disclosed
US-9096795-B2 Liquid crystal display MERCK PATENT GMBH (DE) 2015-08-04 US disclosed
US-20120069289-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-03-22 US disclosed
US-20120069289-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-03-22 US disclosed
WO-2010133278-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2010-11-25 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 (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-20120069289-A1 LIQUID CRYSTAL DISPLAY LPXN, VCL, ACP3 ALDH1A1 3543/4885KDM4E 2926/4885MAPT 38/4885

“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.