SCHEMBL11550658

SCHEMBL11550658

CC(=O)Oc1cc(OC(C)=O)c2c(=O)c(-c3ccccc3)c(C)oc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.68
KDM4E B2RXH2 9/20 0.67
MAPT P10636 6/20 0.67
RAB9A P51151 2/20 0.67
HSD17B10 Q99714 5/20 0.55
ALDH1A1 P00352 5/20 0.55
CASP1 P29466 3/20 0.55
CASP7 P55210 3/20 0.55
GLA P06280 3/20 0.55
GAA P10253 2/20 0.55
TSHR P16473 1/20 0.55
CYP3A4 P08684 3/20 0.52
MAPK1 P28482 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALOX12 P18054 1/20 0.52
TP53 P04637 2/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.51

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
SCHEMBL10472254 0.92 KDM4E (0.72) ADORA3KDM4EMAPTRAB9AHSD17B10
SCHEMBL10471694 0.88 KDM4E (0.68) ADORA3KDM4EMAPTRAB9AHSD17B10
SCHEMBL15266926 0.81 ADORA3 (0.79) ADORA3KDM4EMAPTRAB9AHSD17B10
SCHEMBL1664667 0.81 ADORA3 (1.00) ADORA3KDM4EMAPTRAB9AHSD17B10
SCHEMBL4683758 0.81 KDM4E (1.00) KDM4EMAPTRAB9AHSD17B10ALDH1A1
Chrysin Diacetate SCHEMBL15263635 0.79 KDM4E (0.78) ADORA3KDM4EMAPTRAB9AHSD17B10
SCHEMBL5076327 0.79 KDM4E (0.61) ADORA3KDM4EMAPTRAB9AHSD17B10
SCHEMBL8581726 0.78 ALDH1A1 (0.65) ADORA3KDM4EMAPTRAB9AHSD17B10
SCHEMBL7085863 0.76 KDM4E (0.54) ADORA3KDM4EMAPTRAB9AHSD17B10
SCHEMBL28514417 0.74 ALDH1A1 (0.63) KDM4EMAPTHSD17B10ALDH1A1CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2277595-A2 Compounds for immunopotentiation Novartis Vaccines and Diagnostics, Inc. (US) 2011-01-26 EP disclosed
US-20100226931-A1 Compounds for immunopotentiation NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-09-09 US disclosed
US-20100226931-A1 Compounds for immunopotentiation NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-09-09 US disclosed
US-4166862-A WEIGHT-GAIN PROMOTERS CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1979-09-04 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-20100226931-A1 Compounds for immunopotentiation LY96, ICOS, PDCD1 ADORA3 1365/4885KDM4E 558/4885MAPT 3668/4885

“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.