SCHEMBL8615948

SCHEMBL8615948

CC(C)(C)C1=CC(=O)C(O)=CC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
ALDH1A1 P00352 4/20 0.40
ATM Q13315 2/20 0.40
HPGD P15428 2/20 0.40
CES2 O00748 1/20 0.40
PKM P14618 1/20 0.40
CES1 P23141 1/20 0.40
MPI P34949 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MCL1 Q07820 1/20 0.39
XIAP P98170 1/20 0.33
THRB P10828 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
PTPN22 Q9Y2R2 1/20 0.31
P4HB P07237 1/20 0.30

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
SCHEMBL49783 0.84 MAPT (0.50) MAPTKMT2ALMNAHTTALDH1A1
SCHEMBL8611116 0.79 XIAP (0.37) MAPTKMT2AALDH1A1HPGDXIAP
SCHEMBL169616 0.76 KDM4E (0.43) MAPTKMT2ALMNAALDH1A1ATM
SCHEMBL28875633 0.76 KDM4E (0.43) MAPTKMT2ALMNAALDH1A1ATM
SCHEMBL2552489 0.73 MAPT (0.43) MAPTKMT2ALMNAHTTALDH1A1
SCHEMBL11135771 0.73 KDM4E (0.42) MAPTKMT2ALMNAALDH1A1ATM
SCHEMBL11411413 0.73 KDM4E (0.42) MAPTKMT2ALMNAALDH1A1ATM
Potassium SCHEMBL31397834 0.73 KDM4E (0.42) MAPTKMT2ALMNAALDH1A1ATM
SCHEMBL28391346 0.73 KDM4E (0.42) MAPTKMT2ALMNAALDH1A1ATM
SCHEMBL28480828 0.73 KDM4E (0.47) MAPTKMT2ALMNAALDH1A1ATM

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
US-5780515-A APPLYING TO PLANTS; REDUCED TOXICITY AND IRRITATION ROCKHURST UNIVERSITY (US) 1998-07-14 US claimed
US-20170342094-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2017-11-30 US disclosed
US-9777024-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners, LLC (US) 2017-10-03 US disclosed
US-5780515-A APPLYING TO PLANTS; REDUCED TOXICITY AND IRRITATION ROCKHURST UNIVERSITY (US) 1998-07-14 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-20170342094-A1 HETEROARYL INHIBITORS OF PDE4 PDE4A, PDE4B, PDE4C MAPT 4241/4885KMT2A 3408/4885LMNA 3544/4885

“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.