SCHEMBL16625524

SCHEMBL16625524

COC1=C2CCCCC2CCC1=O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
KMT2A Q03164 1/20 0.31
MAPK1 P28482 1/20 0.31
POLL Q9UGP5 1/20 0.31
ALDH1A1 P00352 2/20 0.31
CYP19A1 P11511 2/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL16179964 0.70 CA1 (0.32) CA1CA2CA4KMT2A
SCHEMBL28921787 0.68 PDGFRB (0.31)
SCHEMBL4077250 0.68 KDM4E (0.31) CA1CA2CA4POLB
SCHEMBL59379 0.65 KDM4E (0.37) CA1CA2CA4KMT2AALDH1A1
SCHEMBL7642946 0.63 CA1 (0.35) CA1CA2CA4KMT2AALDH1A1
SCHEMBL11739358 0.62 KDM4E (0.36) CA1CA2CA4POLB
SCHEMBL28614043 0.62 KDM4E (0.36) CA1CA2CA4POLB
SCHEMBL7635786 0.62 KMT2A (0.38) CA1CA2CA4KMT2AALDH1A1
SCHEMBL7636295 0.62 KMT2A (0.38) CA1CA2CA4KMT2AALDH1A1
SCHEMBL7633674 0.62 KMT2A (0.38) CA1CA2CA4KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9518076-B2 Apparatus and process for preparing reactive lignin with high yield from plant biomass for production of fuels and chemicals WASHINGTON STATE UNIVERSITY (US) 2016-12-13 US disclosed
US-20150099868-A1 APPARATUS AND PROCESS FOR PREPARING REACTIVE LIGNIN WITH HIGH YIELD FROM PLANT BIOMASS FOR PRODUCTION OF FUELS AND CHEMICALS WASHINGTON STATE UNIVERSITY (US) 2015-04-09 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-20150099868-A1 APPARATUS AND PROCESS FOR PREPARING REACTIVE LIGNIN WITH HIGH YIELD FROM PLANT BIOMASS FOR PRODUCTION OF FUELS AND CHEMICALS HAAO, HAO2, HAO1 PDE4A 2905/4885PDE4B 2633/4885PDE4C 3261/4885

“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.